Download citation
Download citation
link to html
The design and synthesis of 3d–4f heterometallic coordination polymers have attracted much inter­est due to the intriguing diversity of their architectures and topologies. Pyridine-2,6-di­carb­oxy­lic acid (H2pydc) has a versatile coordination mode and has been used to construct multinuclear and heterometallic compounds. Two isostructural centrosymmetric 3d–4f coordination compounds constructed from pyridine-2,6-di­carb­oxy­lic acid and 4,4′-bi­pyridine (bpy), namely 4,4′-bi­pyridine-1,1′-diium di­aqua­bis­(μ2-pyridine-2,6-di­carboxyl­ato)tetra­­kis­(pyridine-2,6-di­carboxyl­ato)bis[4-(pyridin-4-yl)pyridinium]cobalt(II)dieuropium(III) octa­hydrate, (C10H10N2)[CoEu2(C10H9N2)2(C7H3NO4)6(H2O)2]·8H2O, (I), and 4,4′-bi­pyridine-1,1′-diium di­aqua­bis­(μ2-pyridine-2,6-di­carboxyl­ato)tetra­kis­(pyridine-2,6-di­carboxyl­ato)bis[4-(pyridin-4-yl)pyridinium]cobalt(II)diterbium(III) octa­hydrate, (C10H10N2)[CoTb2(C10H9N2)2(C7H3NO4)6(H2O)2]·8H2O, (II), were synthesized under hydro­thermal conditions and characterized by IR and fluorescence spectroscopy, thermogravimetric analysis and powder X-ray diffraction. Both compounds crystallize in the triclinic space group P\overline{1}. The EuIII and TbIII cations adopt nine-coordinated distorted tricapped trigonal–prismatic geometries bridged by three pydc2− ligands. The CoII cation has a six-coordination environment formed by two pydc2− ligands, two bpy ligands and two coordinated water mol­ecules. Adjacent mol­ecules are connected by π–π stacking inter­actions to form a one-dimensional chain, which is further extended into a three-dimensional supra­molecular network by multipoint hydrogen bonds.

Supporting information

cif

Crystallographic Information File (CIF) https://doi.org/10.1107/S2053229619006004/lf3091sup1.cif
Contains datablocks Eu, Tb, global

hkl

Structure factor file (CIF format) https://doi.org/10.1107/S2053229619006004/lf3091Eusup2.hkl
Contains datablock Eu

hkl

Structure factor file (CIF format) https://doi.org/10.1107/S2053229619006004/lf3091Tbsup3.hkl
Contains datablock Tb

CCDC references: 1913011; 1913010

Computing details top

For both structures, data collection: APEX2 (Bruker, 2005); cell refinement: APEX2 (Bruker, 2005); data reduction: SAINT (Bruker, 2006); program(s) used to solve structure: SHELXT2014 (Sheldrick, 2015a); program(s) used to refine structure: SHELXL2014 (Sheldrick, 2015b); molecular graphics: SHELXTL (Sheldrick, 2008); software used to prepare material for publication: SHELXTL (Sheldrick, 2008).

4,4'-Bipyridine-1,1'-diium diaquabis(µ2-pyridine-2,6-dicarboxylato)tetrakis(pyridine-2,6-dicarboxylato)bis[4-(pyridin-4-yl)pyridinium]cobalt(II)dieuropium(III) octahydrate (Eu) top
Crystal data top
(C10H10N2)[CoEu2(C7H3NO4)6(C10H9N2)2(H2O)2]·8H2OZ = 1
Mr = 2150.34F(000) = 1087
Triclinic, P1Dx = 1.688 Mg m3
a = 11.9021 (19) ÅMo Kα radiation, λ = 0.71073 Å
b = 12.680 (2) ÅCell parameters from 12178 reflections
c = 14.867 (2) Åθ = 1.7–25.0°
α = 98.597 (2)°µ = 1.76 mm1
β = 99.600 (2)°T = 296 K
γ = 102.882 (2)°Block, pink
V = 2115.6 (6) Å30.20 × 0.18 × 0.18 mm
Data collection top
Bruker SMART CCD APEXII
diffractometer
7015 reflections with I > 2σ(I)
0.5° ω and 0.5° φ scansRint = 0.019
Absorption correction: multi-scan
(SADABS; Krause et al., 2015)
θmax = 25.0°, θmin = 1.7°
Tmin = 0.660, Tmax = 0.700h = 1413
12178 measured reflectionsk = 1315
7429 independent reflectionsl = 1617
Refinement top
Refinement on F20 restraints
Least-squares matrix: fullHydrogen site location: mixed
R[F2 > 2σ(F2)] = 0.026H-atom parameters constrained
wR(F2) = 0.075 w = 1/[σ2(Fo2) + (0.0405P)2 + 2.0276P]
where P = (Fo2 + 2Fc2)/3
S = 1.08(Δ/σ)max = 0.002
7429 reflectionsΔρmax = 1.01 e Å3
584 parametersΔρmin = 0.67 e Å3
Special details top

Geometry. All esds (except the esd in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell esds are taken into account individually in the estimation of esds in distances, angles and torsion angles; correlations between esds in cell parameters are only used when they are defined by crystal symmetry. An approximate (isotropic) treatment of cell esds is used for estimating esds involving l.s. planes.

Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å2) top
xyzUiso*/Ueq
Eu10.57553 (2)0.30582 (2)0.71494 (2)0.02178 (8)
Co11.00000.50001.00000.02301 (13)
O10.6945 (3)0.5793 (2)0.5598 (2)0.0502 (7)
O20.6592 (2)0.47912 (18)0.66888 (16)0.0345 (5)
O30.4547 (2)0.13712 (18)0.61421 (15)0.0335 (5)
O40.3641 (2)0.0320 (2)0.47651 (16)0.0442 (6)
O50.4683 (2)0.21669 (19)0.82287 (16)0.0325 (5)
O60.4449 (3)0.1014 (2)0.9216 (2)0.0550 (7)
O70.7466 (2)0.26312 (19)0.66363 (16)0.0353 (5)
O80.8858 (2)0.1705 (2)0.66152 (19)0.0469 (6)
O90.3869 (2)0.3530 (2)0.68415 (16)0.0359 (5)
O100.2612 (2)0.4520 (3)0.7183 (2)0.0544 (7)
O110.74032 (18)0.39302 (18)0.84981 (15)0.0310 (5)
O120.83304 (19)0.52922 (19)0.97045 (15)0.0323 (5)
O130.95625 (19)0.35526 (18)0.89841 (15)0.0315 (5)
H13A0.98990.34370.85310.038*
H13B0.88960.36600.87770.038*
N10.5417 (2)0.3032 (2)0.54226 (17)0.0259 (5)
N20.5487 (2)0.4631 (2)0.83064 (17)0.0230 (5)
N30.6513 (2)0.1541 (2)0.77982 (17)0.0272 (5)
N41.0615 (2)0.5999 (2)0.90470 (18)0.0302 (6)
N51.2794 (3)0.9073 (2)0.5876 (2)0.0413 (7)
H51.30620.94480.54870.050*
C10.5891 (3)0.3930 (3)0.5108 (2)0.0307 (7)
C20.5778 (3)0.3927 (3)0.4167 (3)0.0443 (9)
H20.61210.45550.39600.053*
C30.5153 (4)0.2984 (4)0.3542 (3)0.0500 (10)
H30.50680.29670.29060.060*
C40.4647 (3)0.2055 (3)0.3869 (2)0.0425 (9)
H40.42120.14100.34600.051*
C50.4810 (3)0.2119 (3)0.4819 (2)0.0294 (7)
C60.6542 (3)0.4933 (3)0.5856 (2)0.0344 (7)
C70.4290 (3)0.1189 (3)0.5269 (2)0.0299 (7)
C80.7458 (3)0.1265 (3)0.7556 (2)0.0339 (7)
C90.7943 (4)0.0496 (4)0.7941 (3)0.0519 (10)
H90.86120.03290.77760.062*
C100.7412 (5)0.0016 (4)0.8572 (4)0.0678 (14)
H100.77120.05480.88280.081*
C110.6441 (4)0.0261 (3)0.8824 (3)0.0520 (10)
H110.60820.00700.92560.062*
C120.6007 (3)0.1048 (3)0.8417 (2)0.0324 (7)
C130.7972 (3)0.1904 (3)0.6874 (2)0.0311 (7)
C140.4960 (3)0.1436 (3)0.8649 (2)0.0331 (7)
C150.6355 (3)0.5186 (2)0.9027 (2)0.0261 (6)
C160.6241 (3)0.6057 (3)0.9645 (3)0.0439 (9)
H160.68570.64321.01400.053*
C170.5193 (4)0.6365 (4)0.9519 (3)0.0595 (12)
H170.50920.69490.99290.071*
C180.4297 (3)0.5795 (3)0.8775 (3)0.0483 (10)
H180.35850.59920.86750.058*
C190.4475 (3)0.4928 (3)0.8182 (2)0.0301 (7)
C200.7449 (3)0.4775 (2)0.9083 (2)0.0248 (6)
C210.3570 (3)0.4266 (3)0.7335 (2)0.0333 (7)
C221.1605 (3)0.6816 (3)0.9309 (2)0.0332 (7)
H221.20000.69680.99270.040*
C231.2067 (3)0.7441 (3)0.8719 (2)0.0346 (7)
H231.27560.80020.89360.042*
C241.1493 (3)0.7228 (3)0.7789 (2)0.0312 (7)
C251.0457 (3)0.6388 (3)0.7512 (2)0.0369 (8)
H251.00430.62190.68980.044*
C261.0055 (3)0.5812 (3)0.8158 (2)0.0361 (8)
H260.93550.52620.79660.043*
C271.3021 (4)0.9539 (3)0.6772 (3)0.0474 (10)
H271.34611.02670.69690.057*
C281.2614 (4)0.8957 (3)0.7405 (3)0.0459 (9)
H281.27800.92900.80300.055*
C291.1954 (3)0.7869 (3)0.7119 (2)0.0330 (7)
C301.1734 (4)0.7413 (3)0.6181 (3)0.0453 (9)
H301.12980.66860.59620.054*
C311.2164 (4)0.8044 (3)0.5573 (3)0.0490 (10)
H311.20080.77400.49420.059*
N60.8356 (3)0.7843 (2)0.5813 (2)0.0407 (7)
H60.79560.73070.60130.049*
C320.9168 (3)0.8635 (3)0.6418 (3)0.0438 (9)
H320.92920.86050.70470.053*
C330.9831 (3)0.9502 (3)0.6120 (2)0.0383 (8)
H331.03971.00570.65470.046*
C340.9651 (3)0.9541 (2)0.5175 (2)0.0285 (7)
C350.8770 (3)0.8697 (3)0.4575 (3)0.0400 (8)
H350.86080.87060.39430.048*
C360.8140 (3)0.7853 (3)0.4910 (3)0.0447 (9)
H360.75620.72880.45040.054*
O140.8869 (3)0.4359 (2)0.5899 (2)0.0582 (8)
H14A0.82920.38590.59560.070*
H14B0.86660.46130.54170.070*
O160.8988 (4)0.7793 (3)0.9531 (3)0.0811 (11)
H16A0.88180.71180.95780.097*
H16B0.86280.81350.98740.097*
O170.0819 (3)0.3147 (4)0.7676 (3)0.0899 (13)
H17A0.02600.27730.72330.108*
H17B0.12710.36270.74680.108*
O181.0249 (3)0.9265 (3)0.8572 (3)0.0814 (11)
H18A0.99470.88870.89390.098*
H18B1.08210.97860.88900.098*
O190.7689 (3)0.7136 (3)0.7568 (2)0.0783 (11)
H19A0.74580.64370.74250.118*
H19B0.79400.72740.81540.118*
O200.2155 (3)0.1689 (3)0.7752 (3)0.0884 (12)
H20A0.28070.19860.76220.106*
H20B0.16940.21110.77010.106*
O151.1020 (3)0.4336 (3)0.5513 (2)0.0731 (10)
H15A1.14940.46730.60190.088*
H15B1.03560.40640.56360.088*
O210.2206 (3)0.1115 (4)0.9370 (3)0.1004 (14)
H21A0.29060.10430.94390.121*
H21B0.20370.13080.88510.121*
Atomic displacement parameters (Å2) top
U11U22U33U12U13U23
Eu10.02158 (10)0.02228 (10)0.02035 (10)0.00196 (6)0.00526 (6)0.00512 (6)
Co10.0214 (3)0.0252 (3)0.0192 (3)0.0002 (2)0.0024 (2)0.0053 (2)
O10.0635 (17)0.0316 (13)0.0532 (16)0.0043 (12)0.0184 (14)0.0182 (12)
O20.0395 (13)0.0266 (11)0.0335 (13)0.0026 (10)0.0101 (10)0.0071 (10)
O30.0446 (13)0.0276 (11)0.0223 (11)0.0043 (10)0.0074 (10)0.0066 (9)
O40.0594 (16)0.0336 (13)0.0250 (12)0.0142 (12)0.0071 (11)0.0019 (10)
O50.0354 (12)0.0365 (12)0.0313 (12)0.0103 (10)0.0145 (10)0.0141 (10)
O60.074 (2)0.0548 (17)0.0553 (17)0.0224 (15)0.0414 (16)0.0302 (14)
O70.0354 (12)0.0402 (13)0.0374 (13)0.0122 (10)0.0184 (10)0.0142 (10)
O80.0386 (14)0.0564 (16)0.0528 (16)0.0200 (12)0.0207 (12)0.0081 (13)
O90.0279 (12)0.0460 (14)0.0292 (12)0.0074 (10)0.0009 (9)0.0036 (11)
O100.0257 (13)0.083 (2)0.0579 (18)0.0232 (13)0.0008 (12)0.0169 (15)
O110.0233 (11)0.0323 (12)0.0319 (12)0.0076 (9)0.0028 (9)0.0021 (10)
O120.0259 (11)0.0359 (12)0.0282 (12)0.0034 (9)0.0019 (9)0.0004 (10)
O130.0286 (11)0.0343 (12)0.0282 (11)0.0043 (9)0.0067 (9)0.0002 (9)
N10.0257 (13)0.0266 (13)0.0251 (13)0.0020 (10)0.0067 (10)0.0100 (11)
N20.0219 (12)0.0249 (12)0.0229 (12)0.0053 (10)0.0058 (10)0.0065 (10)
N30.0296 (13)0.0278 (13)0.0225 (13)0.0055 (11)0.0059 (10)0.0021 (10)
N40.0326 (14)0.0302 (14)0.0278 (14)0.0042 (11)0.0083 (11)0.0091 (11)
N50.0556 (19)0.0341 (16)0.0350 (16)0.0006 (14)0.0207 (14)0.0134 (13)
C10.0292 (16)0.0319 (17)0.0334 (17)0.0036 (13)0.0100 (13)0.0156 (14)
C20.051 (2)0.047 (2)0.036 (2)0.0001 (18)0.0132 (17)0.0234 (17)
C30.062 (3)0.062 (3)0.0251 (18)0.002 (2)0.0114 (17)0.0212 (18)
C40.046 (2)0.046 (2)0.0259 (17)0.0041 (17)0.0055 (15)0.0053 (15)
C50.0285 (16)0.0318 (17)0.0265 (16)0.0018 (13)0.0084 (13)0.0076 (13)
C60.0340 (17)0.0280 (17)0.043 (2)0.0022 (14)0.0158 (15)0.0126 (15)
C70.0330 (17)0.0288 (16)0.0259 (16)0.0006 (13)0.0090 (13)0.0067 (13)
C80.0360 (18)0.0331 (17)0.0328 (17)0.0120 (14)0.0078 (14)0.0016 (14)
C90.060 (3)0.060 (3)0.052 (2)0.036 (2)0.021 (2)0.020 (2)
C100.091 (4)0.071 (3)0.073 (3)0.056 (3)0.031 (3)0.040 (3)
C110.077 (3)0.050 (2)0.047 (2)0.030 (2)0.027 (2)0.0285 (19)
C120.0426 (19)0.0294 (16)0.0245 (16)0.0072 (14)0.0069 (14)0.0065 (13)
C130.0280 (16)0.0363 (18)0.0279 (16)0.0080 (14)0.0072 (13)0.0016 (14)
C140.0403 (18)0.0322 (17)0.0271 (16)0.0053 (14)0.0122 (14)0.0065 (14)
C150.0254 (15)0.0267 (15)0.0253 (15)0.0041 (12)0.0061 (12)0.0050 (12)
C160.041 (2)0.043 (2)0.041 (2)0.0077 (16)0.0059 (16)0.0084 (16)
C170.058 (3)0.053 (2)0.065 (3)0.027 (2)0.016 (2)0.018 (2)
C180.040 (2)0.054 (2)0.057 (2)0.0264 (18)0.0128 (18)0.0029 (19)
C190.0250 (15)0.0381 (18)0.0329 (17)0.0118 (13)0.0106 (13)0.0133 (14)
C200.0247 (15)0.0259 (15)0.0228 (15)0.0032 (12)0.0053 (12)0.0065 (12)
C210.0230 (16)0.046 (2)0.0342 (18)0.0070 (14)0.0059 (13)0.0204 (16)
C220.0341 (17)0.0368 (18)0.0255 (16)0.0016 (14)0.0052 (13)0.0084 (14)
C230.0334 (17)0.0299 (17)0.0353 (18)0.0034 (14)0.0087 (14)0.0061 (14)
C240.0429 (19)0.0246 (15)0.0302 (17)0.0082 (14)0.0160 (14)0.0088 (13)
C250.049 (2)0.0324 (17)0.0260 (17)0.0023 (15)0.0061 (15)0.0089 (14)
C260.0388 (18)0.0357 (18)0.0306 (17)0.0002 (15)0.0075 (14)0.0098 (14)
C270.061 (2)0.0337 (19)0.038 (2)0.0103 (17)0.0162 (18)0.0066 (16)
C280.065 (3)0.0340 (19)0.0304 (18)0.0056 (17)0.0162 (17)0.0027 (15)
C290.0440 (19)0.0257 (16)0.0318 (17)0.0071 (14)0.0146 (14)0.0081 (13)
C300.069 (3)0.0263 (17)0.0339 (19)0.0055 (17)0.0181 (18)0.0046 (15)
C310.078 (3)0.036 (2)0.0277 (18)0.0027 (19)0.0201 (18)0.0042 (15)
N60.0367 (16)0.0310 (15)0.056 (2)0.0016 (13)0.0142 (14)0.0174 (14)
C320.052 (2)0.045 (2)0.037 (2)0.0098 (18)0.0150 (17)0.0161 (17)
C330.046 (2)0.0308 (17)0.0322 (18)0.0007 (15)0.0061 (15)0.0051 (14)
C340.0283 (15)0.0234 (15)0.0329 (17)0.0053 (13)0.0067 (13)0.0040 (13)
C350.044 (2)0.0308 (17)0.0362 (19)0.0042 (15)0.0020 (15)0.0071 (15)
C360.041 (2)0.0313 (18)0.054 (2)0.0032 (15)0.0030 (17)0.0097 (17)
O140.0502 (17)0.0567 (18)0.069 (2)0.0076 (14)0.0178 (15)0.0199 (15)
O160.119 (3)0.070 (2)0.078 (2)0.038 (2)0.052 (2)0.0295 (19)
O170.0490 (19)0.121 (3)0.078 (3)0.013 (2)0.0334 (17)0.021 (2)
O180.084 (3)0.072 (2)0.074 (2)0.0028 (19)0.0012 (19)0.0106 (19)
O190.097 (3)0.060 (2)0.063 (2)0.0059 (19)0.0039 (19)0.0178 (17)
O200.071 (2)0.095 (3)0.101 (3)0.017 (2)0.022 (2)0.029 (2)
O150.0393 (16)0.118 (3)0.069 (2)0.0210 (18)0.0147 (15)0.037 (2)
O210.066 (2)0.105 (3)0.115 (3)0.006 (2)0.035 (2)0.017 (3)
Geometric parameters (Å, º) top
Eu1—O32.416 (2)C11—H110.9300
Eu1—O72.431 (2)C12—C141.511 (5)
Eu1—O92.438 (2)C15—C161.375 (5)
Eu1—O22.448 (2)C15—C201.501 (4)
Eu1—O52.462 (2)C16—C171.379 (6)
Eu1—O112.480 (2)C16—H160.9300
Eu1—N12.526 (2)C17—C181.381 (6)
Eu1—N22.546 (2)C17—H170.9300
Eu1—N32.546 (3)C18—C191.382 (5)
Co1—O122.089 (2)C18—H180.9300
Co1—O12i2.089 (2)C19—C211.509 (5)
Co1—O132.098 (2)C22—C231.370 (5)
Co1—O13i2.098 (2)C22—H220.9300
Co1—N4i2.148 (3)C23—C241.393 (5)
Co1—N42.149 (3)C23—H230.9300
O1—C61.233 (4)C24—C251.392 (5)
O2—C61.271 (4)C24—C291.477 (4)
O3—C71.256 (4)C25—C261.376 (5)
O4—C71.246 (4)C25—H250.9300
O5—C141.264 (4)C26—H260.9300
O6—C141.236 (4)C27—C281.366 (5)
O7—C131.270 (4)C27—H270.9300
O8—C131.244 (4)C28—C291.389 (5)
O9—C211.252 (4)C28—H280.9300
O10—C211.247 (4)C29—C301.384 (5)
O11—C201.259 (4)C30—C311.382 (5)
O12—C201.255 (4)C30—H300.9300
O13—H13A0.8501C31—H310.9300
O13—H13B0.8497N6—C321.326 (5)
N1—C51.330 (4)N6—C361.327 (5)
N1—C11.339 (4)N6—H60.8600
N2—C191.332 (4)C32—C331.380 (5)
N2—C151.338 (4)C32—H320.9300
N3—C121.337 (4)C33—C341.395 (5)
N3—C81.339 (4)C33—H330.9300
N4—C261.337 (4)C34—C351.394 (5)
N4—C221.340 (4)C34—C34ii1.486 (6)
N5—C311.319 (5)C35—C361.371 (5)
N5—C271.332 (5)C35—H350.9300
N5—H50.8600C36—H360.9300
C1—C21.382 (5)O14—H14A0.8499
C1—C61.518 (5)O14—H14B0.8498
C2—C31.374 (6)O16—H16A0.8498
C2—H20.9300O16—H16B0.8501
C3—C41.393 (5)O17—H17A0.8500
C3—H30.9300O17—H17B0.8500
C4—C51.380 (5)O18—H18A0.8503
C4—H40.9300O18—H18B0.8499
C5—C71.507 (4)O19—H19A0.8499
C8—C91.384 (5)O19—H19B0.8503
C8—C131.513 (5)O20—H20A0.8499
C9—C101.378 (6)O20—H20B0.8499
C9—H90.9300O15—H15A0.8500
C10—C111.373 (6)O15—H15B0.8500
C10—H100.9300O21—H21A0.8499
C11—C121.390 (5)O21—H21B0.8500
O3—Eu1—O788.73 (8)N3—C8—C13114.3 (3)
O3—Eu1—O979.51 (8)C9—C8—C13123.8 (3)
O7—Eu1—O9151.08 (8)C10—C9—C8118.6 (4)
O3—Eu1—O2127.13 (7)C10—C9—H9120.7
O7—Eu1—O279.96 (8)C8—C9—H9120.7
O9—Eu1—O286.24 (8)C11—C10—C9119.9 (4)
O3—Eu1—O578.31 (8)C11—C10—H10120.1
O7—Eu1—O5126.47 (8)C9—C10—H10120.1
O9—Eu1—O577.10 (8)C10—C11—C12118.4 (4)
O2—Eu1—O5146.61 (8)C10—C11—H11120.8
O3—Eu1—O11147.25 (8)C12—C11—H11120.8
O7—Eu1—O1176.01 (8)N3—C12—C11121.9 (3)
O9—Eu1—O11126.21 (8)N3—C12—C14114.6 (3)
O2—Eu1—O1179.09 (8)C11—C12—C14123.4 (3)
O5—Eu1—O1187.66 (8)O8—C13—O7125.6 (3)
O3—Eu1—N163.25 (7)O8—C13—C8118.6 (3)
O7—Eu1—N173.61 (8)O7—C13—C8115.8 (3)
O9—Eu1—N177.50 (8)O6—C14—O5126.1 (3)
O2—Eu1—N163.99 (8)O6—C14—C12118.1 (3)
O5—Eu1—N1136.95 (8)O5—C14—C12115.8 (3)
O11—Eu1—N1135.30 (8)N2—C15—C16122.2 (3)
O3—Eu1—N2137.93 (8)N2—C15—C20113.9 (3)
O7—Eu1—N2133.32 (8)C16—C15—C20124.0 (3)
O9—Eu1—N263.53 (8)C15—C16—C17118.7 (3)
O2—Eu1—N272.08 (8)C15—C16—H16120.6
O5—Eu1—N274.60 (8)C17—C16—H16120.6
O11—Eu1—N262.69 (7)C16—C17—C18119.2 (3)
N1—Eu1—N2122.17 (8)C16—C17—H17120.4
O3—Eu1—N375.68 (8)C18—C17—H17120.4
O7—Eu1—N363.42 (8)C17—C18—C19118.9 (3)
O9—Eu1—N3136.29 (8)C17—C18—H18120.6
O2—Eu1—N3137.25 (8)C19—C18—H18120.6
O5—Eu1—N363.06 (8)N2—C19—C18121.8 (3)
O11—Eu1—N371.59 (8)N2—C19—C21114.8 (3)
N1—Eu1—N3120.10 (8)C18—C19—C21123.4 (3)
N2—Eu1—N3117.61 (8)O12—C20—O11125.2 (3)
O12—Co1—O12i180.00 (13)O12—C20—C15117.9 (3)
O12—Co1—O1394.28 (9)O11—C20—C15116.9 (3)
O12i—Co1—O1385.72 (9)O10—C21—O9126.4 (3)
O12—Co1—O13i85.72 (9)O10—C21—C19117.2 (3)
O12i—Co1—O13i94.28 (9)O9—C21—C19116.4 (3)
O13—Co1—O13i180.00 (12)N4—C22—C23123.7 (3)
O12—Co1—N4i88.52 (10)N4—C22—H22118.1
O12i—Co1—N4i91.48 (10)C23—C22—H22118.1
O13—Co1—N4i87.96 (10)C22—C23—C24119.2 (3)
O13i—Co1—N4i92.04 (10)C22—C23—H23120.4
O12—Co1—N491.48 (10)C24—C23—H23120.4
O12i—Co1—N488.52 (10)C25—C24—C23117.5 (3)
O13—Co1—N492.04 (10)C25—C24—C29120.8 (3)
O13i—Co1—N487.96 (10)C23—C24—C29121.6 (3)
N4i—Co1—N4180.0C26—C25—C24119.0 (3)
C6—O2—Eu1125.3 (2)C26—C25—H25120.5
C7—O3—Eu1126.45 (19)C24—C25—H25120.5
C14—O5—Eu1125.8 (2)N4—C26—C25123.7 (3)
C13—O7—Eu1126.3 (2)N4—C26—H26118.1
C21—O9—Eu1125.7 (2)C25—C26—H26118.1
C20—O11—Eu1124.86 (19)N5—C27—C28120.5 (3)
C20—O12—Co1129.6 (2)N5—C27—H27119.7
Co1—O13—H13A126.1C28—C27—H27119.7
Co1—O13—H13B91.3C27—C28—C29120.3 (3)
H13A—O13—H13B108.6C27—C28—H28119.9
C5—N1—C1119.5 (3)C29—C28—H28119.9
C5—N1—Eu1120.50 (19)C30—C29—C28117.5 (3)
C1—N1—Eu1119.9 (2)C30—C29—C24121.2 (3)
C19—N2—C15119.2 (3)C28—C29—C24121.2 (3)
C19—N2—Eu1119.5 (2)C31—C30—C29119.6 (3)
C15—N2—Eu1121.20 (19)C31—C30—H30120.2
C12—N3—C8119.2 (3)C29—C30—H30120.2
C12—N3—Eu1120.5 (2)N5—C31—C30120.9 (3)
C8—N3—Eu1120.2 (2)N5—C31—H31119.6
C26—N4—C22116.8 (3)C30—C31—H31119.6
C26—N4—Co1121.8 (2)C32—N6—C36122.0 (3)
C22—N4—Co1121.3 (2)C32—N6—H6119.0
C31—N5—C27121.2 (3)C36—N6—H6119.0
C31—N5—H5119.4N6—C32—C33120.4 (3)
C27—N5—H5119.4N6—C32—H32119.8
N1—C1—C2121.5 (3)C33—C32—H32119.8
N1—C1—C6115.1 (3)C32—C33—C34119.8 (3)
C2—C1—C6123.4 (3)C32—C33—H33120.1
C3—C2—C1119.1 (3)C34—C33—H33120.1
C3—C2—H2120.5C35—C34—C33117.2 (3)
C1—C2—H2120.4C35—C34—C34ii121.4 (4)
C2—C3—C4119.4 (3)C33—C34—C34ii121.4 (4)
C2—C3—H3120.3C36—C35—C34120.5 (3)
C4—C3—H3120.3C36—C35—H35119.7
C5—C4—C3118.1 (3)C34—C35—H35119.7
C5—C4—H4121.0N6—C36—C35120.1 (3)
C3—C4—H4121.0N6—C36—H36120.0
N1—C5—C4122.4 (3)C35—C36—H36120.0
N1—C5—C7113.8 (3)H14A—O14—H14B109.0
C4—C5—C7123.7 (3)H16A—O16—H16B108.4
O1—C6—O2127.1 (3)H17A—O17—H17B108.8
O1—C6—C1117.3 (3)H18A—O18—H18B108.7
O2—C6—C1115.6 (3)H19A—O19—H19B104.5
O4—C7—O3125.2 (3)H20A—O20—H20B109.7
O4—C7—C5119.0 (3)H15A—O15—H15B108.4
O3—C7—C5115.8 (3)H21A—O21—H21B107.9
N3—C8—C9121.9 (3)
Symmetry codes: (i) x+2, y+1, z+2; (ii) x+2, y+2, z+1.
4,4'-Bipyridine-1,1'-diium diaquabis(µ2-pyridine-2,6-dicarboxylato)tetrakis(pyridine-2,6-dicarboxylato)bis[4-(pyridin-4-yl)pyridinium]cobalt(II)diterbium(III) octahydrate (Tb) top
Crystal data top
(C10H10N2)[CoTb2(C7H3NO4)6(C10H9N2)2(H2O)2]·8H2OZ = 1
Mr = 2164.26F(000) = 1091
Triclinic, P1Dx = 1.706 Mg m3
a = 11.8977 (6) ÅMo Kα radiation, λ = 0.71073 Å
b = 12.6490 (6) ÅCell parameters from 9945 reflections
c = 14.8487 (8) Åθ = 2.0–25.0°
α = 98.518 (1)°µ = 1.96 mm1
β = 99.901 (1)°T = 296 K
γ = 102.715 (1)°Block, pink
V = 2106.78 (19) Å30.21 × 0.20 × 0.17 mm
Data collection top
Bruker SMART CCD APEXII
diffractometer
7395 independent reflections
Radiation source: microfocus sealed X-ray tube, Incoatec Iµs6962 reflections with I > 2σ(I)
Mirror optics monochromatorRint = 0.017
Detector resolution: 7.9 pixels mm-1θmax = 25.0°, θmin = 1.7°
0.5° ω and 0.5° φ scansh = 1413
Absorption correction: multi-scan
(SADABS; Krause et al., 2015)
k = 1215
Tmin = 0.619, Tmax = 0.695l = 1717
12081 measured reflections
Refinement top
Refinement on F2Primary atom site location: dual
Least-squares matrix: fullHydrogen site location: mixed
R[F2 > 2σ(F2)] = 0.026H-atom parameters constrained
wR(F2) = 0.072 w = 1/[σ2(Fo2) + (0.0388P)2 + 2.506P]
where P = (Fo2 + 2Fc2)/3
S = 1.05(Δ/σ)max = 0.001
7395 reflectionsΔρmax = 1.10 e Å3
583 parametersΔρmin = 0.74 e Å3
12 restraints
Special details top

Geometry. All esds (except the esd in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell esds are taken into account individually in the estimation of esds in distances, angles and torsion angles; correlations between esds in cell parameters are only used when they are defined by crystal symmetry. An approximate (isotropic) treatment of cell esds is used for estimating esds involving l.s. planes.

Refinement. 1. Fixed Uiso At 1.2 times of: All C(H) groups, All N(H) groups, All O(H,H) groups 2. Uiso/Uaniso restraints and constraints Uanis(O21) ~ Ueq, Uanis(O20) ~ Ueq: with sigma of 0.008 and sigma for terminal atoms of 0.005 3.a Riding coordinates: O13(H13A,H13B), O14(H14A,H14B), O15(H15A,H15B), O16(H16A,H16B), O17(H17A, H17B), O18(H18A,H18B), O19(H19A,H19B), O20(H20A,H20B), O21(H21A,H21B) 3.b Aromatic/amide H refined with riding coordinates: N5(H5), C2(H2), C3(H3), C4(H4), C9(H9), C10(H10), C11(H11), C16(H16), C17(H17), C18(H18), C22(H22), C25(H25), C26(H26), C27(H27), C28(H28), C30(H30), C31(H31), N6(H6), C32(H32), C33(H33), C35(H35), C36(H36)

Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å2) top
xyzUiso*/Ueq
Tb10.42334 (2)0.19422 (2)0.28485 (2)0.02235 (6)
Co10.0000000.0000000.0000000.02368 (13)
O10.3032 (3)0.0800 (2)0.4374 (2)0.0563 (8)
O20.3390 (2)0.02105 (18)0.32881 (16)0.0355 (5)
O30.5422 (2)0.36242 (18)0.38396 (15)0.0346 (5)
O40.6351 (2)0.4667 (2)0.52259 (17)0.0444 (7)
O50.5305 (2)0.28005 (19)0.17751 (16)0.0335 (5)
O60.5562 (3)0.3959 (2)0.0790 (2)0.0575 (8)
O70.2544 (2)0.2370 (2)0.33648 (17)0.0363 (5)
O80.1154 (2)0.3301 (2)0.3381 (2)0.0494 (7)
O90.6107 (2)0.1490 (2)0.31880 (16)0.0363 (5)
O100.7402 (2)0.0543 (3)0.2847 (2)0.0588 (8)
O110.25987 (19)0.10806 (19)0.15117 (16)0.0318 (5)
O120.16742 (19)0.02932 (19)0.03111 (16)0.0334 (5)
O130.0436 (2)0.14535 (19)0.10167 (16)0.0331 (5)
H13A0.1120490.1388550.1293620.040*
H13B0.0014110.1369750.1401420.040*
N10.4566 (2)0.1960 (2)0.45596 (18)0.0261 (6)
N20.3489 (2)0.3452 (2)0.22002 (18)0.0278 (6)
N30.4515 (2)0.0388 (2)0.17121 (17)0.0239 (5)
N40.0616 (2)0.0997 (2)0.09566 (19)0.0313 (6)
N50.2806 (3)0.4077 (2)0.4122 (2)0.0424 (7)
H50.3083370.4462310.4518670.051*
C10.4092 (3)0.1063 (3)0.4874 (2)0.0313 (7)
C20.4218 (4)0.1058 (3)0.5815 (3)0.0463 (10)
H20.3873850.0412180.6024100.056*
C30.4850 (4)0.2003 (4)0.6449 (3)0.0504 (10)
H30.4939460.2018630.7099030.061*
C40.5354 (3)0.2932 (3)0.6122 (3)0.0436 (9)
H40.5803730.3589120.6541640.052*
C50.5181 (3)0.2872 (3)0.5169 (2)0.0295 (7)
C60.3440 (3)0.0067 (3)0.4118 (3)0.0355 (8)
C70.5689 (3)0.3811 (3)0.4719 (2)0.0307 (7)
C80.2551 (3)0.3738 (3)0.2442 (2)0.0342 (8)
C90.2067 (4)0.4505 (4)0.2056 (3)0.0549 (11)
H90.1385320.4680750.2223580.066*
C100.2596 (5)0.5015 (4)0.1418 (4)0.0712 (15)
H100.2286940.5556510.1151910.085*
C110.3575 (4)0.4734 (4)0.1168 (3)0.0536 (11)
H110.3948580.5075570.0730860.064*
C120.3996 (3)0.3937 (3)0.1576 (2)0.0339 (7)
C130.2033 (3)0.3095 (3)0.3119 (2)0.0335 (7)
C140.5044 (3)0.3541 (3)0.1357 (2)0.0343 (8)
C150.5537 (3)0.0100 (3)0.1842 (2)0.0308 (7)
C160.5729 (4)0.0762 (3)0.1250 (3)0.0485 (10)
H160.6463700.0952220.1352450.058*
C170.4833 (4)0.1341 (4)0.0506 (3)0.0608 (13)
H170.4943850.1937720.0089600.073*
C180.3775 (4)0.1049 (3)0.0370 (3)0.0455 (9)
H180.3148330.1438840.0137470.055*
C190.3647 (3)0.0174 (3)0.0991 (2)0.0270 (7)
C200.6430 (3)0.0771 (3)0.2690 (2)0.0340 (8)
C210.2553 (3)0.0234 (3)0.0931 (2)0.0259 (7)
C220.1611 (3)0.1818 (3)0.0685 (2)0.0348 (8)
H220.2013290.1975380.0051460.042*
C230.2069 (3)0.2436 (3)0.1279 (2)0.0349 (8)
H230.2774140.3007070.1054900.042*
C240.1503 (3)0.2228 (3)0.2209 (2)0.0312 (7)
C250.0469 (3)0.1388 (3)0.2488 (2)0.0379 (8)
H250.0046960.1216990.3116930.046*
C260.0064 (3)0.0808 (3)0.1848 (2)0.0366 (8)
H260.0648110.0242240.2050180.044*
C270.3032 (4)0.4543 (3)0.3222 (3)0.0487 (10)
H270.3484420.5286430.3017460.058*
C280.2620 (4)0.3960 (3)0.2591 (3)0.0464 (10)
H280.2782750.4298770.1951660.056*
C290.1964 (3)0.2870 (3)0.2884 (2)0.0342 (7)
C300.1742 (4)0.2417 (3)0.3821 (3)0.0467 (10)
H300.1296360.1674540.4047560.056*
C310.2173 (4)0.3052 (3)0.4427 (3)0.0504 (11)
H310.2011310.2743650.5073340.060*
O140.0981 (4)0.2816 (3)0.0446 (3)0.0837 (12)
H14A0.1165210.2138330.0407420.100*
H14B0.1356210.3158630.0118020.100*
O150.0270 (4)0.4283 (3)0.1420 (3)0.0858 (11)
H15A0.0018440.3914850.1028940.103*
H15B0.0746740.4851750.1064640.103*
O160.1138 (3)0.0639 (3)0.4102 (2)0.0653 (9)
H16A0.1472400.1185550.3889800.078*
H16B0.0479000.0730150.4200200.078*
O170.7826 (4)0.3307 (4)0.2248 (3)0.1116 (16)
H17A0.7159250.2876080.2225360.134*
H17B0.8363150.2999580.2443260.134*
O180.0997 (3)0.0688 (3)0.5499 (3)0.0787 (11)
H18A0.1562990.0544940.5970510.094*
H18B0.1162490.0231240.5146210.094*
O190.2308 (3)0.2146 (3)0.2416 (2)0.0797 (11)
H19A0.2588820.1455130.2608070.096*
H19B0.1951020.2259430.1849560.096*
O200.0833 (3)0.1896 (4)0.2304 (3)0.0971 (14)
H20A0.0190610.2286640.2657820.116*
H20B0.1157010.1419140.2589720.116*
O210.2194 (4)0.3847 (4)0.0678 (4)0.1160 (17)
H21A0.2034110.3658050.1201770.139*
H21B0.2895910.3920450.0596570.139*
N60.1635 (3)0.2853 (2)0.4170 (2)0.0415 (7)
H60.2041280.2305990.3962070.050*
C320.0819 (4)0.3642 (3)0.3571 (3)0.0446 (9)
H320.0680830.3614850.2926040.054*
C330.0166 (3)0.4508 (3)0.3879 (3)0.0389 (8)
H330.0410950.5080910.3444310.047*
C340.0350 (3)0.4543 (3)0.4822 (2)0.0284 (7)
C350.1227 (3)0.3697 (3)0.5416 (3)0.0417 (9)
H350.1390330.3696110.6065280.050*
C360.1861 (4)0.2860 (3)0.5073 (3)0.0474 (10)
H360.2461780.2285170.5485210.057*
Atomic displacement parameters (Å2) top
U11U22U33U12U13U23
Tb10.02201 (9)0.02243 (9)0.02108 (9)0.00114 (6)0.00463 (6)0.00609 (6)
Co10.0219 (3)0.0250 (3)0.0204 (3)0.0015 (2)0.0020 (2)0.0065 (2)
O10.073 (2)0.0328 (15)0.0567 (18)0.0088 (14)0.0179 (15)0.0191 (13)
O20.0404 (13)0.0254 (12)0.0361 (13)0.0037 (10)0.0099 (11)0.0079 (10)
O30.0464 (14)0.0261 (12)0.0239 (12)0.0073 (10)0.0057 (10)0.0079 (9)
O40.0571 (16)0.0353 (14)0.0254 (12)0.0160 (12)0.0061 (11)0.0024 (10)
O50.0368 (13)0.0354 (13)0.0339 (13)0.0094 (10)0.0153 (10)0.0152 (10)
O60.077 (2)0.0547 (18)0.0595 (19)0.0198 (16)0.0431 (17)0.0322 (15)
O70.0393 (13)0.0385 (13)0.0374 (13)0.0114 (11)0.0177 (11)0.0130 (11)
O80.0424 (15)0.0585 (18)0.0550 (17)0.0214 (13)0.0213 (13)0.0092 (14)
O90.0273 (12)0.0476 (15)0.0290 (12)0.0066 (11)0.0027 (10)0.0060 (11)
O100.0281 (14)0.090 (2)0.0607 (19)0.0247 (15)0.0002 (13)0.0171 (17)
O110.0238 (11)0.0344 (13)0.0311 (12)0.0061 (9)0.0025 (9)0.0008 (10)
O120.0267 (12)0.0365 (13)0.0281 (12)0.0010 (10)0.0029 (9)0.0009 (10)
O130.0271 (12)0.0374 (13)0.0303 (12)0.0033 (10)0.0042 (9)0.0020 (10)
N10.0268 (13)0.0259 (13)0.0258 (13)0.0006 (11)0.0091 (11)0.0108 (11)
N20.0331 (14)0.0250 (13)0.0253 (13)0.0068 (11)0.0065 (11)0.0051 (11)
N30.0217 (13)0.0260 (13)0.0242 (13)0.0045 (10)0.0047 (10)0.0081 (10)
N40.0333 (15)0.0319 (15)0.0285 (14)0.0031 (12)0.0086 (12)0.0108 (12)
N50.057 (2)0.0351 (16)0.0352 (16)0.0002 (14)0.0194 (15)0.0141 (13)
C10.0315 (17)0.0314 (17)0.0332 (18)0.0031 (14)0.0101 (14)0.0161 (14)
C20.053 (2)0.049 (2)0.040 (2)0.0030 (19)0.0153 (18)0.0273 (18)
C30.062 (3)0.059 (3)0.0237 (18)0.001 (2)0.0072 (17)0.0180 (17)
C40.048 (2)0.047 (2)0.0281 (18)0.0049 (17)0.0062 (16)0.0094 (16)
C50.0288 (16)0.0311 (17)0.0260 (16)0.0005 (13)0.0050 (13)0.0089 (13)
C60.0378 (19)0.0266 (17)0.043 (2)0.0017 (14)0.0133 (16)0.0141 (15)
C70.0325 (17)0.0278 (17)0.0280 (17)0.0029 (14)0.0079 (14)0.0075 (13)
C80.0376 (19)0.0344 (18)0.0310 (18)0.0119 (15)0.0068 (14)0.0037 (14)
C90.065 (3)0.059 (3)0.058 (3)0.039 (2)0.021 (2)0.023 (2)
C100.095 (4)0.076 (3)0.074 (3)0.057 (3)0.030 (3)0.044 (3)
C110.079 (3)0.047 (2)0.049 (2)0.027 (2)0.023 (2)0.027 (2)
C120.045 (2)0.0314 (18)0.0257 (17)0.0072 (15)0.0093 (15)0.0067 (14)
C130.0314 (17)0.0338 (18)0.0321 (18)0.0048 (15)0.0074 (14)0.0006 (14)
C140.044 (2)0.0294 (17)0.0293 (17)0.0038 (15)0.0133 (15)0.0074 (14)
C150.0276 (16)0.0371 (18)0.0332 (17)0.0118 (14)0.0105 (14)0.0139 (14)
C160.042 (2)0.050 (2)0.058 (3)0.0251 (19)0.0129 (19)0.0033 (19)
C170.059 (3)0.052 (3)0.069 (3)0.023 (2)0.017 (2)0.015 (2)
C180.044 (2)0.045 (2)0.040 (2)0.0089 (18)0.0049 (17)0.0085 (17)
C190.0272 (16)0.0265 (16)0.0245 (16)0.0017 (13)0.0050 (13)0.0041 (13)
C200.0238 (16)0.045 (2)0.0376 (19)0.0089 (15)0.0069 (14)0.0219 (16)
C210.0242 (15)0.0276 (16)0.0223 (15)0.0009 (13)0.0032 (12)0.0067 (13)
C220.0343 (18)0.0384 (19)0.0275 (17)0.0001 (15)0.0037 (14)0.0103 (14)
C230.0329 (18)0.0335 (18)0.0346 (18)0.0017 (14)0.0088 (14)0.0084 (14)
C240.0413 (19)0.0262 (16)0.0280 (17)0.0049 (14)0.0142 (14)0.0089 (13)
C250.050 (2)0.0317 (18)0.0284 (17)0.0016 (16)0.0071 (16)0.0095 (14)
C260.0385 (19)0.0345 (18)0.0314 (18)0.0040 (15)0.0049 (15)0.0118 (15)
C270.064 (3)0.035 (2)0.037 (2)0.0100 (18)0.0142 (19)0.0061 (16)
C280.063 (3)0.034 (2)0.0329 (19)0.0086 (18)0.0147 (18)0.0037 (15)
C290.044 (2)0.0280 (17)0.0315 (18)0.0038 (15)0.0132 (15)0.0102 (14)
C300.070 (3)0.0288 (19)0.035 (2)0.0065 (18)0.0191 (19)0.0037 (15)
C310.079 (3)0.037 (2)0.0300 (19)0.003 (2)0.0213 (19)0.0038 (16)
O140.127 (3)0.071 (2)0.080 (3)0.044 (2)0.051 (2)0.033 (2)
O150.089 (3)0.078 (3)0.073 (2)0.001 (2)0.000 (2)0.010 (2)
O160.0523 (18)0.062 (2)0.085 (2)0.0097 (15)0.0253 (17)0.0191 (18)
O170.082 (3)0.124 (4)0.124 (4)0.011 (3)0.013 (3)0.042 (3)
O180.0510 (19)0.120 (3)0.078 (2)0.026 (2)0.0181 (17)0.047 (2)
O190.099 (3)0.060 (2)0.063 (2)0.009 (2)0.001 (2)0.0199 (17)
O200.060 (2)0.124 (3)0.088 (3)0.011 (2)0.0397 (19)0.015 (2)
O210.082 (3)0.119 (3)0.131 (3)0.007 (2)0.045 (2)0.022 (3)
N60.0380 (17)0.0313 (16)0.058 (2)0.0022 (13)0.0153 (15)0.0205 (15)
C320.054 (2)0.042 (2)0.040 (2)0.0069 (18)0.0146 (18)0.0163 (17)
C330.048 (2)0.0300 (18)0.0324 (18)0.0012 (16)0.0051 (16)0.0056 (14)
C340.0292 (16)0.0233 (15)0.0326 (17)0.0051 (13)0.0065 (13)0.0071 (13)
C350.045 (2)0.0317 (18)0.039 (2)0.0060 (16)0.0009 (16)0.0087 (15)
C360.042 (2)0.0301 (19)0.060 (3)0.0070 (16)0.0020 (19)0.0101 (18)
Geometric parameters (Å, º) top
Tb1—O22.431 (2)C11—C121.391 (5)
Tb1—O32.393 (2)C12—C141.510 (5)
Tb1—O52.439 (2)C15—C161.382 (5)
Tb1—O72.409 (2)C15—C201.505 (5)
Tb1—O92.411 (2)C16—H160.9500
Tb1—O112.451 (2)C16—C171.380 (6)
Tb1—N12.499 (3)C17—H170.9500
Tb1—N22.520 (3)C17—C181.378 (6)
Tb1—N32.515 (3)C18—H180.9500
Co1—O12i2.092 (2)C18—C191.385 (5)
Co1—O122.092 (2)C19—C211.495 (5)
Co1—O132.102 (2)C22—H220.9500
Co1—O13i2.102 (2)C22—C231.366 (5)
Co1—N4i2.151 (3)C23—H230.9500
Co1—N42.151 (3)C23—C241.388 (5)
O1—C61.238 (4)C24—C251.390 (5)
O2—C61.266 (4)C24—C291.483 (4)
O3—C71.263 (4)C25—H250.9500
O4—C71.240 (4)C25—C261.372 (5)
O5—C141.262 (4)C26—H260.9500
O6—C141.239 (4)C27—H270.9500
O7—C131.270 (4)C27—C281.366 (5)
O8—C131.243 (4)C28—H280.9500
O9—C201.254 (4)C28—C291.390 (5)
O10—C201.244 (4)C29—C301.380 (5)
O11—C211.256 (4)C30—H300.9500
O12—C211.252 (4)C30—C311.382 (5)
O13—H13A0.8735C31—H310.9500
O13—H13B0.8501O14—H14A0.8500
N1—C11.338 (4)O14—H14B0.8499
N1—C51.332 (4)O15—H15A0.8501
N2—C81.335 (4)O15—H15B0.8499
N2—C121.340 (4)O16—H16A0.8504
N3—C151.335 (4)O16—H16B0.8500
N3—C191.338 (4)O17—H17A0.8503
N4—C221.347 (4)O17—H17B0.8498
N4—C261.333 (4)O18—H18A0.8501
N5—H50.8800O18—H18B0.8497
N5—C271.334 (5)O19—H19A0.8500
N5—C311.316 (5)O19—H19B0.8501
C1—C21.380 (5)O20—H20A0.8499
C1—C61.517 (5)O20—H20B0.8498
C2—H20.9500O21—H21A0.8502
C2—C31.382 (6)O21—H21B0.8502
C3—H30.9500N6—H60.8800
C3—C41.390 (5)N6—C321.321 (5)
C4—H40.9500N6—C361.324 (5)
C4—C51.382 (5)C32—H320.9500
C5—C71.511 (4)C32—C331.382 (5)
C8—C91.378 (5)C33—H330.9500
C8—C131.512 (5)C33—C341.389 (5)
C9—H90.9500C34—C34ii1.489 (6)
C9—C101.384 (7)C34—C351.387 (5)
C10—H100.9500C35—H350.9500
C10—C111.382 (7)C35—C361.375 (5)
C11—H110.9500C36—H360.9500
O2—Tb1—O5145.44 (8)N2—C8—C13114.1 (3)
O2—Tb1—O1178.37 (8)C9—C8—C13123.8 (3)
O2—Tb1—N164.42 (8)C8—C9—H9120.7
O2—Tb1—N2137.13 (9)C8—C9—C10118.6 (4)
O2—Tb1—N371.80 (8)C10—C9—H9120.7
O3—Tb1—O2128.23 (8)C9—C10—H10120.0
O3—Tb1—O578.50 (8)C11—C10—C9120.0 (4)
O3—Tb1—O788.30 (8)C11—C10—H10120.0
O3—Tb1—O979.10 (9)C10—C11—H11121.1
O3—Tb1—O11146.71 (8)C10—C11—C12117.9 (4)
O3—Tb1—N163.89 (8)C12—C11—H11121.1
O3—Tb1—N275.02 (8)N2—C12—C11122.1 (3)
O3—Tb1—N3137.70 (8)N2—C12—C14114.5 (3)
O5—Tb1—O1187.75 (8)C11—C12—C14123.5 (3)
O5—Tb1—N1137.21 (8)O7—C13—C8115.8 (3)
O5—Tb1—N263.66 (8)O8—C13—O7125.5 (3)
O5—Tb1—N373.68 (8)O8—C13—C8118.7 (3)
O7—Tb1—O279.81 (8)O5—C14—C12115.9 (3)
O7—Tb1—O5127.59 (8)O6—C14—O5126.1 (3)
O7—Tb1—O9149.74 (8)O6—C14—C12118.1 (3)
O7—Tb1—O1176.29 (8)N3—C15—C16122.0 (3)
O7—Tb1—N173.13 (8)N3—C15—C20114.4 (3)
O7—Tb1—N263.93 (8)C16—C15—C20123.7 (3)
O7—Tb1—N3133.99 (8)C15—C16—H16120.7
O9—Tb1—O286.57 (8)C17—C16—C15118.7 (4)
O9—Tb1—O576.91 (8)C17—C16—H16120.7
O9—Tb1—O11127.29 (8)C16—C17—H17120.2
O9—Tb1—N176.62 (8)C18—C17—C16119.6 (4)
O9—Tb1—N2136.11 (9)C18—C17—H17120.2
O9—Tb1—N364.08 (8)C17—C18—H18120.7
O11—Tb1—N1135.00 (8)C17—C18—C19118.5 (4)
O11—Tb1—N271.71 (8)C19—C18—H18120.7
O11—Tb1—N363.22 (8)N3—C19—C18121.9 (3)
N1—Tb1—N2120.30 (8)N3—C19—C21113.7 (3)
N1—Tb1—N3121.84 (8)C18—C19—C21124.4 (3)
N3—Tb1—N2117.78 (8)O9—C20—C15116.4 (3)
O12i—Co1—O12180.0O10—C20—O9126.2 (3)
O12i—Co1—O1385.89 (9)O10—C20—C15117.3 (3)
O12—Co1—O1394.12 (9)O11—C21—C19116.8 (3)
O12i—Co1—O13i94.12 (9)O12—C21—O11125.6 (3)
O12—Co1—O13i85.88 (9)O12—C21—C19117.5 (3)
O12i—Co1—N4i91.35 (10)N4—C22—H22118.5
O12—Co1—N4i88.65 (10)N4—C22—C23123.1 (3)
O12i—Co1—N488.65 (10)C23—C22—H22118.5
O12—Co1—N491.35 (10)C22—C23—H23120.0
O13—Co1—O13i180.0C22—C23—C24119.9 (3)
O13i—Co1—N488.03 (10)C24—C23—H23120.0
O13—Co1—N491.97 (10)C23—C24—C25117.0 (3)
O13i—Co1—N4i91.97 (10)C23—C24—C29122.2 (3)
O13—Co1—N4i88.03 (10)C25—C24—C29120.8 (3)
N4i—Co1—N4180.0C24—C25—H25120.3
C6—O2—Tb1124.8 (2)C26—C25—C24119.5 (3)
C7—O3—Tb1126.3 (2)C26—C25—H25120.3
C14—O5—Tb1125.6 (2)N4—C26—C25123.5 (3)
C13—O7—Tb1125.9 (2)N4—C26—H26118.2
C20—O9—Tb1125.5 (2)C25—C26—H26118.2
C21—O11—Tb1124.7 (2)N5—C27—H27119.7
C21—O12—Co1129.3 (2)N5—C27—C28120.6 (3)
Co1—O13—H13A97.2C28—C27—H27119.7
Co1—O13—H13B108.8C27—C28—H28120.0
H13A—O13—H13B106.6C27—C28—C29120.0 (3)
C1—N1—Tb1120.1 (2)C29—C28—H28120.0
C5—N1—Tb1120.6 (2)C28—C29—C24120.6 (3)
C5—N1—C1119.3 (3)C30—C29—C24121.5 (3)
C8—N2—Tb1120.2 (2)C30—C29—C28117.8 (3)
C8—N2—C12119.4 (3)C29—C30—H30120.2
C12—N2—Tb1120.3 (2)C29—C30—C31119.5 (3)
C15—N3—Tb1119.6 (2)C31—C30—H30120.2
C15—N3—C19119.4 (3)N5—C31—C30121.0 (3)
C19—N3—Tb1121.0 (2)N5—C31—H31119.5
C22—N4—Co1121.0 (2)C30—C31—H31119.5
C26—N4—Co1122.0 (2)H14A—O14—H14B108.4
C26—N4—C22116.9 (3)H15A—O15—H15B101.8
C27—N5—H5119.4H16A—O16—H16B108.6
C31—N5—H5119.4H17A—O17—H17B108.7
C31—N5—C27121.1 (3)H18A—O18—H18B108.8
N1—C1—C2121.7 (3)H19A—O19—H19B108.6
N1—C1—C6114.6 (3)H20A—O20—H20B108.7
C2—C1—C6123.7 (3)H21A—O21—H21B107.9
C1—C2—H2120.4C32—N6—H6119.0
C1—C2—C3119.2 (3)C32—N6—C36122.0 (3)
C3—C2—H2120.4C36—N6—H6119.0
C2—C3—H3120.4N6—C32—H32119.9
C2—C3—C4119.1 (3)N6—C32—C33120.2 (4)
C4—C3—H3120.4C33—C32—H32119.9
C3—C4—H4120.9C32—C33—H33119.9
C5—C4—C3118.2 (3)C32—C33—C34120.2 (3)
C5—C4—H4120.9C34—C33—H33119.9
N1—C5—C4122.6 (3)C33—C34—C34ii121.5 (4)
N1—C5—C7113.6 (3)C35—C34—C33117.0 (3)
C4—C5—C7123.8 (3)C35—C34—C34ii121.5 (4)
O1—C6—O2127.0 (3)C34—C35—H35119.7
O1—C6—C1117.1 (3)C36—C35—C34120.6 (4)
O2—C6—C1115.9 (3)C36—C35—H35119.7
O3—C7—C5115.5 (3)N6—C36—C35120.1 (4)
O4—C7—O3125.9 (3)N6—C36—H36120.0
O4—C7—C5118.6 (3)C35—C36—H36120.0
N2—C8—C9122.0 (4)
Tb1—O2—C6—O1179.4 (3)C5—N1—C1—C20.4 (5)
Tb1—O2—C6—C10.8 (4)C5—N1—C1—C6178.5 (3)
Tb1—O3—C7—O4176.4 (3)C6—C1—C2—C3178.7 (4)
Tb1—O3—C7—C50.9 (4)C8—N2—C12—C110.1 (5)
Tb1—O5—C14—O6177.7 (3)C8—N2—C12—C14179.8 (3)
Tb1—O5—C14—C121.9 (4)C8—C9—C10—C111.2 (8)
Tb1—O7—C13—O8179.2 (3)C9—C8—C13—O7175.7 (4)
Tb1—O7—C13—C80.2 (4)C9—C8—C13—O83.7 (5)
Tb1—O9—C20—O10178.5 (3)C9—C10—C11—C120.0 (8)
Tb1—O9—C20—C153.6 (4)C10—C11—C12—N20.6 (6)
Tb1—O11—C21—O12171.1 (2)C10—C11—C12—C14179.1 (4)
Tb1—O11—C21—C198.9 (4)C11—C12—C14—O5178.9 (4)
Tb1—N1—C1—C2177.3 (3)C11—C12—C14—O60.7 (6)
Tb1—N1—C1—C63.8 (4)C12—N2—C8—C91.4 (5)
Tb1—N1—C5—C4177.8 (3)C12—N2—C8—C13177.5 (3)
Tb1—N1—C5—C73.6 (4)C13—C8—C9—C10177.7 (4)
Tb1—N2—C8—C9175.5 (3)C15—N3—C19—C180.1 (5)
Tb1—N2—C8—C130.6 (4)C15—N3—C19—C21179.8 (3)
Tb1—N2—C12—C11176.8 (3)C15—C16—C17—C180.1 (7)
Tb1—N2—C12—C142.9 (4)C16—C15—C20—O9176.4 (4)
Tb1—N3—C15—C16178.6 (3)C16—C15—C20—O101.6 (5)
Tb1—N3—C15—C200.1 (4)C16—C17—C18—C190.1 (7)
Tb1—N3—C19—C18178.4 (3)C17—C18—C19—N30.1 (6)
Tb1—N3—C19—C211.4 (3)C17—C18—C19—C21180.0 (4)
Co1—O12—C21—O110.1 (5)C18—C19—C21—O11175.6 (3)
Co1—O12—C21—C19179.9 (2)C18—C19—C21—O124.4 (5)
Co1—N4—C22—C23176.6 (3)C19—N3—C15—C160.2 (5)
Co1—N4—C26—C25176.2 (3)C19—N3—C15—C20178.3 (3)
N1—C1—C2—C30.1 (6)C20—C15—C16—C17178.2 (4)
N1—C1—C6—O1176.8 (3)C22—N4—C26—C251.2 (6)
N1—C1—C6—O22.0 (5)C22—C23—C24—C250.6 (5)
N1—C5—C7—O33.0 (4)C22—C23—C24—C29179.7 (3)
N1—C5—C7—O4174.6 (3)C23—C24—C25—C260.3 (5)
N2—C8—C9—C102.0 (7)C23—C24—C29—C2829.0 (6)
N2—C8—C13—O70.3 (4)C23—C24—C29—C30152.1 (4)
N2—C8—C13—O8179.7 (3)C24—C25—C26—N40.6 (6)
N2—C12—C14—O50.8 (4)C24—C29—C30—C31178.9 (4)
N2—C12—C14—O6179.6 (3)C25—C24—C29—C28150.7 (4)
N3—C15—C16—C170.2 (6)C25—C24—C29—C3028.2 (6)
N3—C15—C20—O92.1 (4)C26—N4—C22—C230.9 (5)
N3—C15—C20—O10179.8 (3)C27—N5—C31—C301.2 (7)
N3—C19—C21—O114.5 (4)C27—C28—C29—C24179.5 (4)
N3—C19—C21—O12175.5 (3)C27—C28—C29—C300.6 (6)
N4—C22—C23—C240.0 (6)C28—C29—C30—C310.0 (6)
N5—C27—C28—C290.3 (7)C29—C24—C25—C26180.0 (3)
C1—N1—C5—C40.0 (5)C29—C30—C31—N50.9 (7)
C1—N1—C5—C7178.6 (3)C31—N5—C27—C280.6 (7)
C1—C2—C3—C40.7 (7)N6—C32—C33—C341.1 (6)
C2—C1—C6—O12.1 (6)C32—N6—C36—C350.9 (6)
C2—C1—C6—O2179.1 (4)C32—C33—C34—C34ii179.2 (4)
C2—C3—C4—C51.0 (6)C32—C33—C34—C351.7 (5)
C3—C4—C5—N10.7 (6)C33—C34—C35—C361.0 (6)
C3—C4—C5—C7179.2 (4)C34ii—C34—C35—C36179.9 (4)
C4—C5—C7—O3178.5 (4)C34—C35—C36—N60.2 (6)
C4—C5—C7—O44.0 (5)C36—N6—C32—C330.3 (6)
Symmetry codes: (i) x, y, z; (ii) x, y1, z+1.
 

Follow Acta Cryst. C
Sign up for e-alerts
Follow Acta Cryst. on Twitter
Follow us on facebook
Sign up for RSS feeds