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In the title compound, [Ni(C14H10N2O3)(C5H5N)3]·1.5C5H5N, the NiII ion is coordinated by one N and two O atoms from a Schiff base ligand and by the N atoms of three pyridine mol­ecules to form a distorted octa­hedral geometry.

Supporting information

cif

Crystallographic Information File (CIF) https://doi.org/10.1107/S1600536805035701/ci6663sup1.cif
Contains datablocks global, I

hkl

Structure factor file (CIF format) https://doi.org/10.1107/S1600536805035701/ci6663Isup2.hkl
Contains datablock I

CCDC reference: 256321

Key indicators

  • Single-crystal X-ray study
  • T = 293 K
  • Mean [sigma](C-C) = 0.007 Å
  • Disorder in solvent or counterion
  • R factor = 0.054
  • wR factor = 0.155
  • Data-to-parameter ratio = 15.7

checkCIF/PLATON results

No syntax errors found



Alert level C PLAT041_ALERT_1_C Calc. and Rep. SumFormula Strings Differ .... ? PLAT042_ALERT_1_C Calc. and Rep. MoietyFormula Strings Differ .... ? PLAT045_ALERT_1_C Calculated and Reported Z Differ by ............ 0.50 Ratio PLAT094_ALERT_2_C Ratio of Maximum / Minimum Residual Density .... 3.42 PLAT199_ALERT_1_C Check the Reported _cell_measurement_temperature 293 K PLAT200_ALERT_1_C Check the Reported _diffrn_ambient_temperature . 293 K PLAT241_ALERT_2_C Check High Ueq as Compared to Neighbors for C4 PLAT241_ALERT_2_C Check High Ueq as Compared to Neighbors for C18 PLAT242_ALERT_2_C Check Low Ueq as Compared to Neighbors for N3 PLAT243_ALERT_4_C High 'Solvent' Ueq as Compared to Neighbors for N6 PLAT243_ALERT_4_C High 'Solvent' Ueq as Compared to Neighbors for C33 PLAT244_ALERT_4_C Low 'Solvent' Ueq as Compared to Neighbors for C34 PLAT302_ALERT_4_C Anion/Solvent Disorder ......................... 12.00 Perc. PLAT341_ALERT_3_C Low Bond Precision on C-C bonds (x 1000) Ang ... 7 PLAT366_ALERT_2_C Short? C(sp?)-C(sp?) Bond C35 - C37_a ... 1.34 Ang.
0 ALERT level A = In general: serious problem 0 ALERT level B = Potentially serious problem 15 ALERT level C = Check and explain 0 ALERT level G = General alerts; check 5 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 5 ALERT type 2 Indicator that the structure model may be wrong or deficient 1 ALERT type 3 Indicator that the structure quality may be low 4 ALERT type 4 Improvement, methodology, query or suggestion

Computing details top

Data collection: SMART (Bruker, 2000); cell refinement: SAINT (Bruker, 2000); data reduction: SAINT; program(s) used to solve structure: SHELXS97 (Sheldrick, 1997); program(s) used to refine structure: SHELXL97 (Sheldrick, 1997); molecular graphics: SHELXTL (Bruker, 1997); software used to prepare material for publication: SHELXTL.

Tris(pyridine-kN)[salicylaldehyde (2-hydroxybenzoyl)hydrazonato-k2N,O]nickel(II) pyridine sesquisolvate top
Crystal data top
[Ni(C14H10N2O3)(C5H5N)3]·1.5C5H5NF(000) = 1396
Mr = 668.90Dx = 1.309 Mg m3
Monoclinic, P21/nMo Kα radiation, λ = 0.71073 Å
Hall symbol: -P 2ynCell parameters from 6390 reflections
a = 12.5579 (10) Åθ = 2.3–24.7°
b = 20.3993 (17) ŵ = 0.62 mm1
c = 13.2756 (11) ÅT = 293 K
β = 93.493 (1)°Block, red
V = 3394.5 (5) Å30.40 × 0.30 × 0.20 mm
Z = 4
Data collection top
Bruker SMART CCD area-detector
diffractometer
6652 independent reflections
Radiation source: fine-focus sealed tube5272 reflections with I > 2σ(I)
Graphite monochromatorRint = 0.022
φ and ω scansθmax = 26.0°, θmin = 1.8°
Absorption correction: multi-scan
(SADABS; Bruker, 2000)
h = 1515
Tmin = 0.791, Tmax = 0.887k = 1925
18260 measured reflectionsl = 1615
Refinement top
Refinement on F2Primary atom site location: structure-invariant direct methods
Least-squares matrix: fullSecondary atom site location: difference Fourier map
R[F2 > 2σ(F2)] = 0.054Hydrogen site location: inferred from neighbouring sites
wR(F2) = 0.155H-atom parameters constrained
S = 1.03 w = 1/[σ2(Fo2) + (0.0779P)2 + 1.8492P]
where P = (Fo2 + 2Fc2)/3
6652 reflections(Δ/σ)max = 0.001
425 parametersΔρmax = 1.31 e Å3
3 restraintsΔρmin = 0.38 e Å3
Special details top

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

Refinement. Refinement of F2 against ALL reflections. The weighted R-factor wR and goodness of fit S are based on F2, conventional R-factors R are based on F, with F set to zero for negative F2. The threshold expression of F2 > σ(F2) is used only for calculating R-factors(gt) etc. and is not relevant to the choice of reflections for refinement. R-factors based on F2 are statistically about twice as large as those based on F, and R- factors based on ALL data will be even larger.

Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å2) top
xyzUiso*/UeqOcc. (<1)
Ni0.65046 (3)0.230127 (18)0.50273 (3)0.05522 (15)
N10.76084 (19)0.13964 (11)0.37957 (17)0.0576 (6)
N20.77516 (18)0.19882 (12)0.42990 (17)0.0541 (5)
N30.50755 (19)0.25283 (13)0.56663 (18)0.0588 (6)
N40.7114 (2)0.18844 (14)0.64428 (19)0.0682 (7)
N50.58664 (18)0.27192 (12)0.36084 (18)0.0587 (6)
N60.8332 (8)0.8952 (3)0.6927 (5)0.196 (3)
O10.7967 (2)0.04657 (14)0.2580 (2)0.1016 (9)
H10.81010.07860.29390.152*
O20.59816 (16)0.13937 (9)0.45611 (15)0.0624 (5)
O30.72353 (16)0.31435 (10)0.53899 (15)0.0648 (5)
C10.7014 (3)0.02285 (15)0.2774 (2)0.0685 (8)
C20.6650 (4)0.03255 (18)0.2278 (3)0.0866 (11)
H20.70690.05190.18060.104*
C30.5685 (4)0.06022 (19)0.2459 (3)0.1023 (13)
H30.54540.09770.21120.123*
C40.5069 (4)0.0326 (2)0.3147 (4)0.1077 (14)
H40.44230.05180.32860.129*
C50.5398 (3)0.02344 (16)0.3637 (3)0.0768 (9)
H50.49630.04220.41010.092*
C60.6357 (2)0.05295 (14)0.3463 (2)0.0602 (7)
C70.6653 (2)0.11458 (14)0.3985 (2)0.0572 (7)
C80.8628 (2)0.22989 (14)0.4203 (2)0.0583 (7)
H80.91250.21040.38080.070*
C90.8911 (2)0.29200 (17)0.4651 (2)0.0647 (8)
C100.9969 (3)0.3141 (2)0.4551 (3)0.0829 (10)
H101.04170.28890.41730.099*
C111.0365 (3)0.3707 (2)0.4983 (3)0.0976 (12)
H111.10640.38370.49020.117*
C120.9690 (4)0.4084 (2)0.5551 (3)0.1004 (13)
H120.99400.44690.58550.121*
C130.8656 (3)0.38860 (16)0.5658 (3)0.0750 (9)
H130.82200.41500.60300.090*
C140.8222 (3)0.33010 (15)0.5232 (2)0.0624 (7)
C150.4744 (3)0.31341 (16)0.5783 (3)0.0750 (9)
H150.51850.34740.55970.090*
C160.3787 (3)0.3293 (2)0.6161 (3)0.0873 (11)
H160.35960.37290.62360.105*
C170.3125 (3)0.2811 (2)0.6426 (3)0.0881 (11)
H170.24710.29070.66850.106*
C180.3440 (3)0.2181 (2)0.6304 (4)0.1102 (16)
H180.30030.18360.64770.132*
C190.4421 (3)0.20568 (19)0.5920 (4)0.0945 (13)
H190.46270.16230.58360.113*
C200.6178 (3)0.33035 (18)0.3298 (3)0.0772 (9)
H200.66040.35590.37420.093*
C210.5905 (3)0.3549 (2)0.2360 (3)0.0927 (11)
H210.61450.39600.21740.111*
C220.5281 (3)0.3188 (3)0.1704 (3)0.0963 (13)
H220.50860.33430.10600.116*
C230.4948 (4)0.2593 (3)0.2012 (3)0.0972 (13)
H230.45170.23330.15810.117*
C240.5249 (3)0.23775 (18)0.2955 (3)0.0767 (9)
H240.50090.19690.31530.092*
C250.7137 (3)0.2240 (2)0.7277 (3)0.0895 (11)
H250.68690.26650.72440.107*
C260.7549 (4)0.2001 (3)0.8203 (3)0.1059 (14)
H260.75570.22650.87750.127*
C270.7934 (4)0.1387 (3)0.8265 (4)0.1115 (15)
H270.82070.12190.88790.134*
C280.7918 (4)0.1013 (2)0.7409 (4)0.1045 (13)
H280.81820.05870.74270.125*
C290.7503 (3)0.12822 (19)0.6522 (3)0.0814 (10)
H290.74950.10260.59420.098*
C300.7414 (6)0.9049 (4)0.6297 (9)0.196 (4)
H300.67460.89220.64920.235*
C310.7533 (7)0.9334 (4)0.5397 (7)0.165 (3)
H310.69440.93970.49480.198*
C320.8454 (8)0.9516 (4)0.5163 (5)0.163 (3)
H320.85340.97540.45740.196*
C330.9293 (6)0.9367 (5)0.5760 (8)0.191 (4)
H330.99650.94760.55550.229*
C340.9228 (6)0.9088 (4)0.6585 (6)0.155 (3)
H340.98500.89760.69610.186*
N70.5798 (5)0.4869 (2)0.5722 (4)0.1244 (15)0.50
C350.4799 (6)0.4981 (3)0.5967 (4)0.1213 (17)
H350.46430.49720.66430.146*
C360.5798 (5)0.4869 (2)0.5722 (4)0.1244 (15)0.50
H360.63390.47790.62110.149*0.50
C370.5987 (5)0.4892 (3)0.4739 (6)0.1256 (18)
H370.66750.48190.45420.151*
Atomic displacement parameters (Å2) top
U11U22U33U12U13U23
Ni0.0487 (2)0.0611 (2)0.0566 (2)0.00001 (15)0.00857 (15)0.00507 (16)
N10.0571 (14)0.0578 (13)0.0589 (13)0.0058 (11)0.0106 (11)0.0072 (11)
N20.0476 (12)0.0631 (14)0.0521 (12)0.0010 (10)0.0063 (9)0.0035 (11)
N30.0556 (14)0.0619 (14)0.0598 (14)0.0015 (11)0.0116 (11)0.0055 (11)
N40.0622 (15)0.0834 (18)0.0597 (15)0.0054 (13)0.0086 (12)0.0020 (13)
N50.0467 (12)0.0715 (16)0.0578 (13)0.0007 (11)0.0019 (10)0.0081 (11)
N60.217 (8)0.192 (6)0.180 (6)0.034 (6)0.022 (6)0.068 (5)
O10.108 (2)0.0911 (19)0.111 (2)0.0098 (16)0.0508 (17)0.0322 (16)
O20.0589 (12)0.0593 (11)0.0709 (12)0.0027 (9)0.0195 (10)0.0111 (9)
O30.0558 (12)0.0689 (12)0.0696 (12)0.0089 (10)0.0022 (9)0.0090 (10)
C10.085 (2)0.0599 (17)0.0616 (17)0.0053 (16)0.0151 (16)0.0026 (14)
C20.111 (3)0.067 (2)0.083 (2)0.005 (2)0.013 (2)0.0112 (18)
C30.129 (4)0.065 (2)0.111 (3)0.011 (2)0.010 (3)0.022 (2)
C40.096 (3)0.078 (3)0.149 (4)0.024 (2)0.007 (3)0.025 (3)
C50.068 (2)0.0637 (19)0.100 (2)0.0117 (15)0.0135 (18)0.0149 (17)
C60.0646 (18)0.0540 (16)0.0618 (16)0.0010 (13)0.0019 (13)0.0004 (13)
C70.0575 (16)0.0584 (16)0.0563 (15)0.0003 (13)0.0081 (12)0.0020 (13)
C80.0489 (15)0.0699 (18)0.0563 (16)0.0050 (13)0.0038 (12)0.0004 (13)
C90.0598 (17)0.0743 (19)0.0593 (17)0.0109 (15)0.0010 (14)0.0101 (15)
C100.065 (2)0.097 (3)0.086 (2)0.0280 (19)0.0029 (17)0.012 (2)
C110.082 (3)0.106 (3)0.106 (3)0.035 (2)0.005 (2)0.005 (3)
C120.101 (3)0.090 (3)0.108 (3)0.041 (2)0.014 (2)0.002 (2)
C130.080 (2)0.0659 (19)0.078 (2)0.0143 (17)0.0074 (17)0.0063 (16)
C140.0683 (18)0.0626 (17)0.0547 (15)0.0093 (14)0.0091 (13)0.0069 (13)
C150.076 (2)0.0635 (19)0.088 (2)0.0027 (16)0.0219 (17)0.0092 (17)
C160.086 (2)0.080 (2)0.098 (3)0.017 (2)0.028 (2)0.015 (2)
C170.066 (2)0.107 (3)0.095 (3)0.011 (2)0.0290 (19)0.017 (2)
C180.082 (3)0.093 (3)0.162 (4)0.013 (2)0.062 (3)0.012 (3)
C190.081 (2)0.067 (2)0.141 (4)0.0026 (18)0.052 (2)0.003 (2)
C200.078 (2)0.079 (2)0.072 (2)0.0096 (18)0.0133 (17)0.0051 (17)
C210.088 (3)0.105 (3)0.084 (2)0.007 (2)0.006 (2)0.025 (2)
C220.087 (3)0.142 (4)0.058 (2)0.018 (3)0.0066 (18)0.007 (2)
C230.091 (3)0.120 (3)0.077 (2)0.001 (3)0.025 (2)0.017 (2)
C240.068 (2)0.083 (2)0.077 (2)0.0043 (17)0.0117 (17)0.0084 (17)
C250.092 (3)0.114 (3)0.064 (2)0.019 (2)0.0086 (18)0.006 (2)
C260.103 (3)0.154 (4)0.061 (2)0.012 (3)0.008 (2)0.008 (3)
C270.102 (3)0.149 (5)0.082 (3)0.005 (3)0.006 (2)0.032 (3)
C280.106 (3)0.098 (3)0.107 (3)0.005 (2)0.016 (3)0.021 (3)
C290.079 (2)0.086 (2)0.078 (2)0.0018 (19)0.0056 (18)0.0070 (19)
C300.105 (5)0.185 (7)0.297 (12)0.007 (5)0.004 (6)0.100 (8)
C310.139 (6)0.167 (6)0.180 (7)0.011 (5)0.054 (5)0.036 (5)
C320.175 (7)0.211 (8)0.103 (4)0.017 (7)0.010 (5)0.027 (4)
C330.117 (6)0.293 (11)0.164 (7)0.005 (6)0.032 (5)0.031 (8)
C340.109 (5)0.224 (8)0.132 (5)0.028 (5)0.003 (4)0.020 (5)
N70.140 (4)0.107 (3)0.127 (4)0.000 (3)0.013 (3)0.010 (3)
C350.158 (5)0.116 (4)0.096 (3)0.020 (4)0.048 (4)0.012 (3)
C360.140 (4)0.107 (3)0.127 (4)0.000 (3)0.013 (3)0.010 (3)
C370.117 (4)0.115 (4)0.150 (5)0.009 (3)0.049 (4)0.029 (4)
Geometric parameters (Å, º) top
Ni—O31.993 (2)C13—H130.93
Ni—N21.995 (2)C15—C161.369 (5)
Ni—O22.0475 (19)C15—H150.93
Ni—N32.083 (2)C16—C171.348 (5)
Ni—N42.160 (3)C16—H160.93
Ni—N52.176 (2)C17—C181.358 (6)
N1—C71.341 (4)C17—H170.93
N1—N21.386 (3)C18—C191.384 (5)
N2—C81.283 (4)C18—H180.93
N3—C151.316 (4)C19—H190.93
N3—C191.322 (4)C20—C211.367 (5)
N4—C251.322 (4)C20—H200.93
N4—C291.324 (4)C21—C221.354 (6)
N5—C241.325 (4)C21—H210.93
N5—C201.328 (4)C22—C231.355 (6)
N6—C341.270 (9)C22—H220.93
N6—C301.396 (10)C23—C241.359 (5)
O1—C11.330 (4)C23—H230.93
O1—H10.82C24—H240.93
O2—C71.277 (3)C25—C261.392 (6)
O3—C141.309 (4)C25—H250.93
C1—C21.372 (5)C26—C271.344 (7)
C1—C61.410 (4)C26—H260.93
C2—C31.372 (6)C27—C281.367 (7)
C2—H20.93C27—H270.93
C3—C41.354 (6)C28—C291.372 (5)
C3—H30.93C28—H280.93
C4—C51.368 (5)C29—H290.93
C4—H40.93C30—C311.344 (10)
C5—C61.378 (4)C30—H300.93
C5—H50.93C31—C321.273 (9)
C6—C71.472 (4)C31—H310.93
C8—C91.435 (4)C32—C331.315 (9)
C8—H80.93C32—H320.93
C9—C101.417 (4)C33—C341.241 (10)
C9—C141.424 (5)C33—H330.93
C10—C111.370 (5)C34—H340.93
C10—H100.93N7—C351.335 (7)
C11—C121.399 (6)N7—C371.342 (7)
C11—H110.93C35—C37i1.344 (8)
C12—C131.375 (5)C35—H350.93
C12—H120.93C37—C35i1.344 (8)
C13—C141.416 (4)C37—H370.93
O3—Ni—N291.70 (9)O3—C14—C13119.2 (3)
O3—Ni—O2170.75 (8)O3—C14—C9124.4 (3)
N2—Ni—O279.10 (9)C13—C14—C9116.4 (3)
O3—Ni—N396.05 (9)N3—C15—C16123.8 (3)
N2—Ni—N3171.75 (9)N3—C15—H15118.1
O2—Ni—N393.19 (9)C16—C15—H15118.1
O3—Ni—N489.76 (10)C17—C16—C15119.6 (4)
N2—Ni—N492.80 (9)C17—C16—H16120.2
O2—Ni—N489.83 (10)C15—C16—H16120.2
N3—Ni—N490.08 (10)C16—C17—C18118.0 (3)
O3—Ni—N590.64 (9)C16—C17—H17121.0
N2—Ni—N587.96 (9)C18—C17—H17121.0
O2—Ni—N589.90 (9)C17—C18—C19119.3 (4)
N3—Ni—N589.11 (9)C17—C18—H18120.3
N4—Ni—N5179.13 (9)C19—C18—H18120.3
C7—N1—N2109.4 (2)N3—C19—C18122.8 (4)
C8—N2—N1118.0 (2)N3—C19—H19118.6
C8—N2—Ni126.4 (2)C18—C19—H19118.6
N1—N2—Ni115.45 (16)N5—C20—C21123.3 (3)
C15—N3—C19116.5 (3)N5—C20—H20118.4
C15—N3—Ni122.9 (2)C21—C20—H20118.4
C19—N3—Ni120.4 (2)C22—C21—C20119.4 (4)
C25—N4—C29116.9 (3)C22—C21—H21120.3
C25—N4—Ni120.1 (3)C20—C21—H21120.3
C29—N4—Ni123.0 (2)C21—C22—C23118.0 (4)
C24—N5—C20116.2 (3)C21—C22—H22121.0
C24—N5—Ni122.0 (2)C23—C22—H22121.0
C20—N5—Ni121.3 (2)C22—C23—C24119.7 (4)
C34—N6—C30118.2 (7)C22—C23—H23120.2
C1—O1—H1109.5C24—C23—H23120.2
C7—O2—Ni109.12 (17)N5—C24—C23123.5 (4)
C14—O3—Ni126.80 (19)N5—C24—H24118.3
O1—C1—C2119.0 (3)C23—C24—H24118.3
O1—C1—C6122.4 (3)N4—C25—C26122.4 (4)
C2—C1—C6118.6 (3)N4—C25—H25118.8
C3—C2—C1121.8 (4)C26—C25—H25118.8
C3—C2—H2119.1C27—C26—C25119.5 (4)
C1—C2—H2119.1C27—C26—H26120.2
C4—C3—C2119.6 (4)C25—C26—H26120.2
C4—C3—H3120.2C26—C27—C28118.8 (4)
C2—C3—H3120.2C26—C27—H27120.6
C3—C4—C5120.0 (4)C28—C27—H27120.6
C3—C4—H4120.0C27—C28—C29118.4 (4)
C5—C4—H4120.0C27—C28—H28120.8
C4—C5—C6121.9 (4)C29—C28—H28120.8
C4—C5—H5119.1N4—C29—C28124.0 (4)
C6—C5—H5119.1N4—C29—H29118.0
C5—C6—C1118.1 (3)C28—C29—H29118.0
C5—C6—C7119.5 (3)C31—C30—N6117.5 (7)
C1—C6—C7122.4 (3)C31—C30—H30121.2
O2—C7—N1126.3 (3)N6—C30—H30121.2
O2—C7—C6117.5 (3)C32—C31—C30119.7 (7)
N1—C7—C6116.1 (2)C32—C31—H31120.2
N2—C8—C9126.0 (3)C30—C31—H31120.2
N2—C8—H8117.0C31—C32—C33119.4 (8)
C9—C8—H8117.0C31—C32—H32120.3
C10—C9—C14118.8 (3)C33—C32—H32120.3
C10—C9—C8116.8 (3)C34—C33—C32123.0 (8)
C14—C9—C8124.2 (3)C34—C33—H33118.5
C11—C10—C9123.1 (4)C32—C33—H33118.5
C11—C10—H10118.4C33—C34—N6121.5 (8)
C9—C10—H10118.4C33—C34—H34119.2
C10—C11—C12118.3 (4)N6—C34—H34119.2
C10—C11—H11120.9C35—N7—C37117.2 (5)
C12—C11—H11120.9N7—C35—C37i121.6 (5)
C13—C12—C11120.1 (4)N7—C35—H35119.2
C13—C12—H12120.0C37i—C35—H35119.2
C11—C12—H12120.0N7—C37—C35i121.3 (5)
C12—C13—C14123.3 (4)N7—C37—H37119.4
C12—C13—H13118.4C35i—C37—H37119.4
C14—C13—H13118.4
C7—N1—N2—C8180.0 (3)N2—N1—C7—O22.0 (4)
C7—N1—N2—Ni4.3 (3)N2—N1—C7—C6177.1 (2)
O3—Ni—N2—C80.5 (2)C5—C6—C7—O22.2 (4)
O2—Ni—N2—C8178.7 (3)C1—C6—C7—O2177.0 (3)
N4—Ni—N2—C889.4 (3)C5—C6—C7—N1178.5 (3)
N5—Ni—N2—C891.1 (2)C1—C6—C7—N12.3 (4)
O3—Ni—N2—N1174.80 (18)N1—N2—C8—C9178.9 (3)
O2—Ni—N2—N16.07 (18)Ni—N2—C8—C93.8 (4)
N4—Ni—N2—N195.35 (19)N2—C8—C9—C10172.6 (3)
N5—Ni—N2—N184.22 (19)N2—C8—C9—C143.5 (5)
O3—Ni—N3—C1526.0 (3)C14—C9—C10—C110.3 (5)
O2—Ni—N3—C15154.4 (3)C8—C9—C10—C11176.6 (3)
N4—Ni—N3—C15115.7 (3)C9—C10—C11—C120.0 (6)
N5—Ni—N3—C1564.6 (3)C10—C11—C12—C130.4 (7)
O3—Ni—N3—C19158.3 (3)C11—C12—C13—C141.0 (6)
O2—Ni—N3—C1921.3 (3)Ni—O3—C14—C13171.6 (2)
N4—Ni—N3—C1968.5 (3)Ni—O3—C14—C98.3 (4)
N5—Ni—N3—C19111.2 (3)C12—C13—C14—O3178.6 (3)
O3—Ni—N4—C2540.4 (3)C12—C13—C14—C91.3 (5)
N2—Ni—N4—C25132.1 (3)C10—C9—C14—O3179.0 (3)
O2—Ni—N4—C25148.9 (3)C8—C9—C14—O33.0 (5)
N3—Ni—N4—C2555.7 (3)C10—C9—C14—C130.9 (4)
O3—Ni—N4—C29137.7 (3)C8—C9—C14—C13176.9 (3)
N2—Ni—N4—C2946.0 (3)C19—N3—C15—C161.3 (6)
O2—Ni—N4—C2933.1 (3)Ni—N3—C15—C16177.2 (3)
N3—Ni—N4—C29126.3 (3)N3—C15—C16—C170.8 (6)
O3—Ni—N5—C24179.8 (3)C15—C16—C17—C180.0 (7)
N2—Ni—N5—C2488.5 (3)C16—C17—C18—C190.2 (8)
O2—Ni—N5—C249.5 (3)C15—N3—C19—C181.0 (7)
N3—Ni—N5—C2483.7 (3)Ni—N3—C19—C18177.0 (4)
O3—Ni—N5—C208.4 (3)C17—C18—C19—N30.3 (8)
N2—Ni—N5—C2083.3 (3)C24—N5—C20—C210.9 (5)
O2—Ni—N5—C20162.4 (3)Ni—N5—C20—C21171.4 (3)
N3—Ni—N5—C20104.4 (3)N5—C20—C21—C220.3 (6)
N2—Ni—O2—C76.51 (19)C20—C21—C22—C230.3 (7)
N3—Ni—O2—C7170.54 (19)C21—C22—C23—C240.3 (7)
N4—Ni—O2—C799.39 (19)C20—N5—C24—C230.9 (5)
N5—Ni—O2—C781.44 (19)Ni—N5—C24—C23171.4 (3)
N2—Ni—O3—C146.4 (2)C22—C23—C24—N50.3 (7)
N3—Ni—O3—C14176.5 (2)C29—N4—C25—C260.0 (6)
N4—Ni—O3—C1486.4 (2)Ni—N4—C25—C26178.2 (3)
N5—Ni—O3—C1494.3 (2)N4—C25—C26—C270.4 (7)
O1—C1—C2—C3178.6 (4)C25—C26—C27—C280.5 (8)
C6—C1—C2—C32.1 (6)C26—C27—C28—C290.3 (7)
C1—C2—C3—C40.2 (7)C25—N4—C29—C280.2 (6)
C2—C3—C4—C51.7 (7)Ni—N4—C29—C28178.3 (3)
C3—C4—C5—C60.9 (7)C27—C28—C29—N40.1 (7)
C4—C5—C6—C11.4 (6)C34—N6—C30—C315.5 (11)
C4—C5—C6—C7177.8 (4)N6—C30—C31—C321.7 (12)
O1—C1—C6—C5177.9 (3)C30—C31—C32—C336.6 (14)
C2—C1—C6—C52.8 (5)C31—C32—C33—C344.6 (17)
O1—C1—C6—C72.9 (5)C32—C33—C34—N63.1 (17)
C2—C1—C6—C7176.4 (3)C30—N6—C34—C337.9 (14)
Ni—O2—C7—N16.9 (4)C37—N7—C35—C37i0.4 (10)
Ni—O2—C7—C6172.3 (2)C35—N7—C37—C35i0.4 (9)
Symmetry code: (i) x+1, y+1, z+1.
Hydrogen-bond geometry (Å, º) top
D—H···AD—HH···AD···AD—H···A
O1—H1···N10.821.822.549 (3)147
C16—H16···O1ii0.932.583.356 (5)141
C20—H20···O30.932.433.022 (4)121
C24—H24···O20.932.473.030 (4)119
C19—H19···O20.932.523.059 (4)118
Symmetry code: (ii) x1/2, y+1/2, z+1/2.
 

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