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The title compound, [Nd(C2HCl2O2)3(C10H8N2)]n, was synthesized by reaction of neodymium(III) dichloro­acetate with 2,2′-bipyridine in a water–ethanol (1:1) solution. The structure consists of chains running along the a axis. The Nd3+ ions are coordinated by seven O and two N atoms, giving a distorted monocapped square anti­prism.

Supporting information

cif

Crystallographic Information File (CIF) https://doi.org/10.1107/S1600536806022872/ww2021sup1.cif
Contains datablocks global, I

hkl

Structure factor file (CIF format) https://doi.org/10.1107/S1600536806022872/ww2021Isup2.hkl
Contains datablock I

CCDC reference: 613849

Key indicators

  • Single-crystal X-ray study
  • T = 293 K
  • Mean [sigma](C-C) = 0.009 Å
  • R factor = 0.031
  • wR factor = 0.073
  • Data-to-parameter ratio = 15.2

checkCIF/PLATON results

No syntax errors found



Alert level B PLAT029_ALERT_3_B _diffrn_measured_fraction_theta_full Low ....... 0.94 PLAT242_ALERT_2_B Check Low Ueq as Compared to Neighbors for C22
Alert level C ABSTM02_ALERT_3_C The ratio of Tmax/Tmin expected RT(exp) is > 1.10 Absorption corrections should be applied. Tmin and Tmax expected: 0.731 0.812 RT(exp) = 1.111 PLAT022_ALERT_3_C Ratio Unique / Expected Reflections too Low .... 0.91 PLAT057_ALERT_3_C Correction for Absorption Required RT(exp) ... 1.11 PLAT199_ALERT_1_C Check the Reported _cell_measurement_temperature 293 K PLAT242_ALERT_2_C Check Low Ueq as Compared to Neighbors for C12 PLAT242_ALERT_2_C Check Low Ueq as Compared to Neighbors for C32 PLAT342_ALERT_3_C Low Bond Precision on C-C bonds (x 1000) Ang ... 9 PLAT764_ALERT_4_C Overcomplete CIF Bond List Detected (Rep/Expd) . 1.11 Ratio
0 ALERT level A = In general: serious problem 2 ALERT level B = Potentially serious problem 8 ALERT level C = Check and explain 0 ALERT level G = General alerts; check 1 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 3 ALERT type 2 Indicator that the structure model may be wrong or deficient 5 ALERT type 3 Indicator that the structure quality may be low 1 ALERT type 4 Improvement, methodology, query or suggestion
checkCIF publication errors
Alert level A PUBL023_ALERT_1_A There is a mismatched ^ on line 154 atoms, with C---H = 0.98 (Csp^3^) or 0.93\%A (Csp^2) and U~iso~(H) = If you require a ^ then it should be escaped with a \, i.e. \^ Otherwise there must be a matching closing ~, e.g. ^12^C
1 ALERT level A = Data missing that is essential or data in wrong format 0 ALERT level G = General alerts. Data that may be required is missing

Computing details top

Data collection: IPDS Software (Stoe & Cie, 1998); cell refinement: IPDS Software; data reduction: IPDS Software; program(s) used to solve structure: SHELXS97 (Sheldrick, 1997); program(s) used to refine structure: SHELXL97 (Sheldrick, 1997); molecular graphics: DIAMOND (Brandenburg, 2001); software used to prepare material for publication: SHELXL97.

catena-Poly[[(2,2'-bipyridine-κ2N,N')neodymium(III)]-µ-dichloroacetato- 1κ2O,O':2κO-di-µ-dichloroacetato-κ4O:O'-[(2,2'- bipyridine-κ2N,N')neodymium(III)]-di-µ-dichloroacetato-κ4O:O'] top
Crystal data top
[Nd(C2HCl2O2)3(C10H8N2)]Z = 2
Mr = 684.21F(000) = 662
Triclinic, P1Dx = 1.968 Mg m3
Hall symbol: -P 1Mo Kα radiation, λ = 0.71073 Å
a = 8.8492 (8) ÅCell parameters from 7998 reflections
b = 12.2399 (12) Åθ = 2.0–26.0°
c = 12.3403 (12) ŵ = 2.98 mm1
α = 109.336 (11)°T = 293 K
β = 104.427 (11)°Needle, violet
γ = 102.457 (11)°0.22 × 0.09 × 0.07 mm
V = 1154.6 (3) Å3
Data collection top
Stoe IPDS area-detector
diffractometer
3542 reflections with I > 2σ(I)
Radiation source: fine-focus sealed tubeRint = 0.040
Graphite monochromatorθmax = 26.2°, θmin = 2.0°
φ scansh = 1010
16610 measured reflectionsk = 1515
4248 independent reflectionsl = 1515
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)] = 0.031Hydrogen site location: inferred from neighbouring sites
wR(F2) = 0.073H-atom parameters constrained
S = 0.98 w = 1/[σ2(Fo2) + (0.0442P)2]
where P = (Fo2 + 2Fc2)/3
4248 reflections(Δ/σ)max < 0.001
280 parametersΔρmax = 0.77 e Å3
0 restraintsΔρmin = 1.14 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 > 2σ(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*/Ueq
Nd10.34649 (3)0.11522 (2)0.00876 (2)0.01886 (8)
O110.6529 (5)0.0814 (3)0.0029 (3)0.0336 (8)
O120.5965 (4)0.2458 (3)0.0123 (4)0.0347 (8)
C110.6839 (6)0.1782 (4)0.0204 (4)0.0278 (10)
C120.8309 (6)0.2043 (5)0.0616 (5)0.0364 (12)
H120.90120.15690.04120.044*
Cl110.94692 (19)0.36060 (15)0.0109 (2)0.0673 (5)
Cl120.7547 (3)0.1566 (2)0.22212 (17)0.0720 (5)
O210.0547 (4)0.0074 (3)0.1113 (3)0.0318 (8)
O220.1946 (4)0.1187 (3)0.1491 (3)0.0397 (9)
C210.0683 (6)0.0873 (4)0.1730 (4)0.0279 (10)
C220.0590 (7)0.1707 (5)0.2928 (5)0.0446 (14)
H220.04430.13240.30110.054*
Cl210.2250 (3)0.1876 (3)0.41739 (15)0.0987 (8)
Cl220.0607 (5)0.3126 (2)0.2929 (3)0.1287 (12)
O310.5378 (4)0.1479 (3)0.2038 (3)0.0342 (8)
O320.3398 (4)0.0038 (3)0.1994 (3)0.0308 (8)
C310.6073 (6)0.0862 (5)0.2500 (4)0.0288 (11)
C320.6222 (7)0.1183 (6)0.3844 (5)0.0457 (15)
H320.51090.10820.38820.055*
Cl310.7028 (3)0.0244 (2)0.44699 (16)0.0788 (6)
Cl320.7419 (3)0.2730 (2)0.47433 (16)0.0973 (8)
N10.3993 (5)0.3470 (4)0.1385 (4)0.0312 (9)
N20.2472 (5)0.2457 (4)0.1057 (4)0.0286 (9)
C10.4641 (8)0.3928 (5)0.2607 (5)0.0436 (14)
H10.49100.34130.29770.052*
C20.4930 (9)0.5144 (5)0.3348 (6)0.0527 (16)
H20.53950.54360.41950.063*
C30.4521 (8)0.5899 (5)0.2811 (6)0.0528 (17)
H30.46920.67130.32910.063*
C40.3854 (7)0.5453 (5)0.1561 (6)0.0427 (14)
H40.35660.59580.11830.051*
C50.3611 (6)0.4224 (4)0.0859 (5)0.0293 (11)
C60.2876 (6)0.3683 (4)0.0482 (5)0.0277 (10)
C70.2536 (7)0.4387 (5)0.1148 (6)0.0407 (13)
H70.28610.52350.07470.049*
C80.1723 (8)0.3823 (6)0.2390 (6)0.0476 (15)
H80.14690.42790.28380.057*
C90.1291 (7)0.2572 (6)0.2961 (5)0.0458 (14)
H90.07320.21660.38020.055*
C100.1697 (7)0.1929 (5)0.2273 (5)0.0386 (13)
H100.14190.10840.26700.046*
Atomic displacement parameters (Å2) top
U11U22U33U12U13U23
Nd10.01749 (12)0.01791 (12)0.02344 (12)0.00592 (8)0.00954 (9)0.00922 (9)
O110.048 (2)0.0177 (16)0.0403 (19)0.0059 (15)0.0202 (17)0.0179 (15)
O120.0258 (17)0.0294 (18)0.063 (2)0.0131 (15)0.0270 (17)0.0240 (18)
C110.024 (2)0.025 (2)0.035 (3)0.005 (2)0.014 (2)0.014 (2)
C120.031 (3)0.038 (3)0.063 (4)0.021 (2)0.027 (3)0.032 (3)
Cl110.0365 (8)0.0439 (8)0.1308 (17)0.0078 (7)0.0452 (10)0.0380 (10)
Cl120.0739 (12)0.1064 (15)0.0634 (11)0.0372 (12)0.0472 (10)0.0456 (11)
O210.0205 (16)0.0361 (19)0.0322 (18)0.0016 (15)0.0086 (14)0.0113 (15)
O220.0259 (18)0.050 (2)0.0304 (18)0.0033 (17)0.0164 (15)0.0063 (17)
C210.023 (2)0.034 (3)0.024 (2)0.006 (2)0.009 (2)0.011 (2)
C220.034 (3)0.048 (3)0.040 (3)0.005 (3)0.022 (2)0.002 (3)
Cl210.1021 (16)0.148 (2)0.0280 (8)0.0530 (16)0.0121 (9)0.0152 (11)
Cl220.198 (3)0.0857 (17)0.153 (3)0.096 (2)0.102 (2)0.0462 (17)
O310.0359 (19)0.0379 (19)0.0248 (17)0.0193 (16)0.0040 (15)0.0081 (15)
O320.0345 (18)0.0363 (18)0.0286 (17)0.0189 (16)0.0145 (15)0.0144 (15)
C310.022 (2)0.036 (3)0.025 (2)0.011 (2)0.0074 (19)0.008 (2)
C320.047 (3)0.069 (4)0.026 (3)0.033 (3)0.015 (2)0.014 (3)
Cl310.1144 (17)0.1094 (16)0.0445 (9)0.0683 (14)0.0316 (10)0.0463 (10)
Cl320.134 (2)0.0751 (13)0.0362 (9)0.0377 (14)0.0056 (11)0.0097 (9)
N10.034 (2)0.027 (2)0.035 (2)0.0103 (18)0.0175 (19)0.0112 (18)
N20.025 (2)0.029 (2)0.035 (2)0.0107 (17)0.0115 (17)0.0139 (18)
C10.062 (4)0.030 (3)0.037 (3)0.015 (3)0.019 (3)0.010 (2)
C20.071 (4)0.033 (3)0.041 (3)0.013 (3)0.018 (3)0.003 (3)
C30.056 (4)0.027 (3)0.061 (4)0.015 (3)0.021 (3)0.000 (3)
C40.037 (3)0.025 (3)0.059 (4)0.014 (2)0.013 (3)0.010 (3)
C50.022 (2)0.023 (2)0.050 (3)0.0108 (19)0.018 (2)0.017 (2)
C60.023 (2)0.026 (2)0.047 (3)0.012 (2)0.021 (2)0.021 (2)
C70.042 (3)0.037 (3)0.065 (4)0.019 (3)0.031 (3)0.034 (3)
C80.049 (4)0.060 (4)0.064 (4)0.027 (3)0.030 (3)0.047 (3)
C90.045 (3)0.064 (4)0.040 (3)0.022 (3)0.015 (3)0.033 (3)
C100.040 (3)0.039 (3)0.040 (3)0.016 (2)0.011 (2)0.019 (2)
Geometric parameters (Å, º) top
Nd1—O11i2.385 (3)C31—O32i1.249 (5)
Nd1—O312.421 (3)C31—C321.537 (7)
Nd1—O212.436 (3)C32—Cl321.759 (7)
Nd1—O222.438 (4)C32—Cl311.759 (6)
Nd1—O322.476 (3)C32—H320.9800
Nd1—O122.559 (4)N1—C11.337 (7)
Nd1—N22.607 (4)N1—C51.346 (6)
Nd1—N12.622 (4)N2—C101.339 (6)
Nd1—O112.860 (4)N2—C61.349 (6)
Nd1—C113.061 (5)C1—C21.391 (7)
O11—C111.259 (6)C1—H10.9300
O11—Nd1i2.385 (3)C2—C31.362 (9)
O12—C111.246 (5)C2—H20.9300
C11—C121.519 (7)C3—C41.370 (9)
C12—Cl111.754 (6)C3—H30.9300
C12—Cl121.766 (6)C4—C51.401 (7)
C12—H120.9800C4—H40.9300
O21—C211.252 (6)C5—C61.467 (7)
O22—C21ii1.240 (6)C6—C71.401 (7)
C21—O22ii1.240 (6)C7—C81.371 (9)
C21—C221.527 (7)C7—H70.9300
C22—Cl221.733 (7)C8—C91.374 (9)
C22—Cl211.760 (6)C8—H80.9300
C22—H220.9800C9—C101.372 (8)
O31—C311.258 (6)C9—H90.9300
O32—C31i1.249 (5)C10—H100.9300
O11i—Nd1—O3172.82 (12)Cl12—C12—H12109.2
O11i—Nd1—O2183.35 (12)C21—O21—Nd1153.1 (3)
O31—Nd1—O21137.38 (13)C21ii—O22—Nd1152.9 (3)
O11i—Nd1—O2285.87 (13)O22ii—C21—O21127.8 (4)
O31—Nd1—O2272.01 (12)O22ii—C21—C22117.7 (4)
O21—Nd1—O2271.48 (11)O21—C21—C22114.4 (5)
O11i—Nd1—O3274.43 (12)C21—C22—Cl22110.9 (5)
O31—Nd1—O32128.20 (11)C21—C22—Cl21109.9 (4)
O21—Nd1—O3275.21 (11)Cl22—C22—Cl21110.3 (3)
O22—Nd1—O32142.92 (12)C21—C22—H22108.6
O11i—Nd1—O12117.25 (11)Cl22—C22—H22108.6
O31—Nd1—O1285.10 (13)Cl21—C22—H22108.6
O21—Nd1—O12137.52 (12)C31—O31—Nd1137.6 (3)
O22—Nd1—O12141.24 (11)C31i—O32—Nd1138.4 (3)
O32—Nd1—O1275.66 (12)O32i—C31—O31128.0 (4)
O11i—Nd1—N2148.55 (12)O32i—C31—C32118.6 (4)
O31—Nd1—N2138.39 (12)O31—C31—C32113.4 (4)
O21—Nd1—N273.29 (12)C31—C32—Cl32109.9 (5)
O22—Nd1—N2105.65 (13)C31—C32—Cl31114.1 (4)
O32—Nd1—N279.37 (11)Cl32—C32—Cl31109.9 (3)
O12—Nd1—N271.46 (12)C31—C32—H32107.5
O11i—Nd1—N1148.84 (13)Cl32—C32—H32107.5
O31—Nd1—N178.42 (12)Cl31—C32—H32107.5
O21—Nd1—N1111.26 (12)C1—N1—C5118.1 (4)
O22—Nd1—N173.93 (13)C1—N1—Nd1119.9 (3)
O32—Nd1—N1134.88 (13)C5—N1—Nd1121.9 (3)
O12—Nd1—N171.03 (12)C10—N2—C6118.3 (4)
N2—Nd1—N161.81 (12)C10—N2—Nd1119.6 (3)
O11i—Nd1—O1169.80 (13)C6—N2—Nd1121.7 (3)
O31—Nd1—O1166.32 (11)N1—C1—C2122.8 (5)
O21—Nd1—O11136.57 (10)N1—C1—H1118.6
O22—Nd1—O11136.21 (11)C2—C1—H1118.6
O32—Nd1—O1165.21 (10)C3—C2—C1118.9 (6)
O12—Nd1—O1147.65 (9)C3—C2—H2120.6
N2—Nd1—O11114.12 (11)C1—C2—H2120.6
N1—Nd1—O11109.17 (11)C2—C3—C4119.6 (5)
O11i—Nd1—C1193.74 (13)C2—C3—H3120.2
O31—Nd1—C1176.31 (13)C4—C3—H3120.2
O21—Nd1—C11141.38 (12)C3—C4—C5119.1 (5)
O22—Nd1—C11146.94 (12)C3—C4—H4120.4
O32—Nd1—C1167.00 (12)C5—C4—H4120.4
O12—Nd1—C1123.52 (11)N1—C5—C4121.6 (5)
N2—Nd1—C1191.75 (13)N1—C5—C6116.6 (4)
N1—Nd1—C1190.84 (13)C4—C5—C6121.8 (5)
O11—Nd1—C1124.25 (11)N2—C6—C7120.7 (5)
C11—O11—Nd1i160.6 (3)N2—C6—C5117.0 (4)
C11—O11—Nd186.8 (3)C7—C6—C5122.3 (4)
Nd1i—O11—Nd1110.20 (13)C8—C7—C6119.9 (5)
C11—O12—Nd1101.4 (3)C8—C7—H7120.1
O12—C11—O11123.5 (5)C6—C7—H7120.1
O12—C11—C12121.0 (4)C7—C8—C9118.8 (5)
O11—C11—C12115.4 (4)C7—C8—H8120.6
O12—C11—Nd155.0 (2)C9—C8—H8120.6
O11—C11—Nd168.9 (3)C10—C9—C8119.0 (5)
C12—C11—Nd1168.2 (3)C10—C9—H9120.5
C11—C12—Cl11110.9 (4)C8—C9—H9120.5
C11—C12—Cl12107.8 (4)N2—C10—C9123.3 (5)
Cl11—C12—Cl12110.6 (3)N2—C10—H10118.4
C11—C12—H12109.2C9—C10—H10118.4
Cl11—C12—H12109.2
O11i—Nd1—O11—C11170.4 (3)O11i—Nd1—O31—C3111.9 (5)
O31—Nd1—O11—C11110.1 (3)O21—Nd1—O31—C3170.9 (5)
O21—Nd1—O11—C11115.0 (3)O22—Nd1—O31—C31103.1 (5)
O22—Nd1—O11—C11129.3 (3)O32—Nd1—O31—C3141.2 (6)
O32—Nd1—O11—C1188.7 (3)O12—Nd1—O31—C31108.6 (5)
O12—Nd1—O11—C114.3 (3)N2—Nd1—O31—C31163.4 (5)
N2—Nd1—O11—C1124.1 (3)N1—Nd1—O31—C31179.8 (5)
N1—Nd1—O11—C1142.8 (3)O11—Nd1—O31—C3163.1 (5)
O11i—Nd1—O11—Nd1i0.0C11—Nd1—O31—C3186.5 (5)
O31—Nd1—O11—Nd1i79.49 (15)O11i—Nd1—O32—C31i32.3 (5)
O21—Nd1—O11—Nd1i55.4 (2)O31—Nd1—O32—C31i20.1 (6)
O22—Nd1—O11—Nd1i60.4 (2)O21—Nd1—O32—C31i119.4 (5)
O32—Nd1—O11—Nd1i81.66 (14)O22—Nd1—O32—C31i92.8 (5)
O12—Nd1—O11—Nd1i174.6 (2)O12—Nd1—O32—C31i91.9 (5)
N2—Nd1—O11—Nd1i146.23 (13)N2—Nd1—O32—C31i165.3 (5)
N1—Nd1—O11—Nd1i146.87 (14)N1—Nd1—O32—C31i135.2 (5)
C11—Nd1—O11—Nd1i170.4 (3)O11—Nd1—O32—C31i42.3 (5)
O11i—Nd1—O12—C111.3 (3)C11—Nd1—O32—C31i68.7 (5)
O31—Nd1—O12—C1166.5 (3)Nd1—O31—C31—O32i36.5 (9)
O21—Nd1—O12—C11113.0 (3)Nd1—O31—C31—C32142.1 (4)
O22—Nd1—O12—C11119.5 (3)O32i—C31—C32—Cl32120.2 (5)
O32—Nd1—O12—C1165.0 (3)O31—C31—C32—Cl3261.1 (5)
N2—Nd1—O12—C11148.4 (3)O32i—C31—C32—Cl313.9 (7)
N1—Nd1—O12—C11146.0 (3)O31—C31—C32—Cl31174.9 (4)
O11—Nd1—O12—C114.4 (3)O11i—Nd1—N1—C15.2 (5)
Nd1—O12—C11—O118.9 (5)O31—Nd1—N1—C117.6 (4)
Nd1—O12—C11—C12166.8 (4)O21—Nd1—N1—C1119.0 (4)
Nd1i—O11—C11—O12159.6 (7)O22—Nd1—N1—C156.8 (4)
Nd1—O11—C11—O127.8 (5)O32—Nd1—N1—C1151.0 (4)
Nd1i—O11—C11—C1216.2 (12)O12—Nd1—N1—C1106.4 (4)
Nd1—O11—C11—C12168.1 (4)N2—Nd1—N1—C1175.0 (5)
Nd1i—O11—C11—Nd1151.9 (10)O11—Nd1—N1—C177.3 (4)
O11i—Nd1—C11—O12178.9 (3)C11—Nd1—N1—C193.4 (4)
O31—Nd1—C11—O12109.8 (3)O11i—Nd1—N1—C5173.9 (3)
O21—Nd1—C11—O1294.8 (3)O31—Nd1—N1—C5163.3 (4)
O22—Nd1—C11—O1293.0 (4)O21—Nd1—N1—C560.1 (4)
O32—Nd1—C11—O12107.5 (3)O22—Nd1—N1—C5122.3 (4)
N2—Nd1—C11—O1229.8 (3)O32—Nd1—N1—C529.9 (5)
N1—Nd1—C11—O1232.0 (3)O12—Nd1—N1—C574.5 (4)
O11—Nd1—C11—O12172.1 (5)N2—Nd1—N1—C54.1 (4)
O11i—Nd1—C11—O119.1 (3)O11—Nd1—N1—C5103.6 (4)
O31—Nd1—C11—O1162.2 (3)C11—Nd1—N1—C587.5 (4)
O21—Nd1—C11—O1193.1 (3)O11i—Nd1—N2—C109.2 (5)
O22—Nd1—C11—O1179.1 (4)O31—Nd1—N2—C10162.1 (4)
O32—Nd1—C11—O1180.4 (3)O21—Nd1—N2—C1052.9 (4)
O12—Nd1—C11—O11172.1 (5)O22—Nd1—N2—C10117.5 (4)
N2—Nd1—C11—O11158.1 (3)O32—Nd1—N2—C1024.7 (4)
N1—Nd1—C11—O11140.1 (3)O12—Nd1—N2—C10103.0 (4)
O11i—Nd1—C11—C12105.0 (16)N1—Nd1—N2—C10179.1 (4)
O31—Nd1—C11—C12176.3 (16)O11—Nd1—N2—C1081.2 (4)
O21—Nd1—C11—C1220.9 (17)C11—Nd1—N2—C1090.9 (4)
O22—Nd1—C11—C12166.9 (15)O11i—Nd1—N2—C6178.3 (3)
O32—Nd1—C11—C1233.6 (16)O31—Nd1—N2—C610.4 (5)
O12—Nd1—C11—C1273.9 (16)O21—Nd1—N2—C6134.6 (4)
N2—Nd1—C11—C1244.1 (16)O22—Nd1—N2—C669.9 (4)
N1—Nd1—C11—C12105.9 (16)O32—Nd1—N2—C6147.8 (4)
O11—Nd1—C11—C12114.0 (17)O12—Nd1—N2—C669.5 (4)
O12—C11—C12—Cl1144.3 (6)N1—Nd1—N2—C68.4 (3)
O11—C11—C12—Cl11139.7 (4)O11—Nd1—N2—C691.3 (4)
Nd1—C11—C12—Cl11111.0 (15)C11—Nd1—N2—C681.6 (4)
O12—C11—C12—Cl1276.9 (5)C5—N1—C1—C20.1 (9)
O11—C11—C12—Cl1299.1 (4)Nd1—N1—C1—C2179.1 (5)
Nd1—C11—C12—Cl1210.2 (18)N1—C1—C2—C30.8 (10)
O11i—Nd1—O21—C2111.2 (7)C1—C2—C3—C40.7 (10)
O31—Nd1—O21—C2166.7 (8)C2—C3—C4—C50.1 (10)
O22—Nd1—O21—C2199.1 (7)C1—N1—C5—C41.0 (8)
O32—Nd1—O21—C2164.4 (7)Nd1—N1—C5—C4178.2 (4)
O12—Nd1—O21—C21112.5 (7)C1—N1—C5—C6179.0 (5)
N2—Nd1—O21—C21147.5 (8)Nd1—N1—C5—C60.1 (6)
N1—Nd1—O21—C21162.7 (7)C3—C4—C5—N11.0 (8)
O11—Nd1—O21—C2139.8 (8)C3—C4—C5—C6178.9 (5)
C11—Nd1—O21—C2176.4 (8)C10—N2—C6—C71.9 (7)
O11i—Nd1—O22—C21ii75.7 (8)Nd1—N2—C6—C7170.7 (4)
O31—Nd1—O22—C21ii149.0 (8)C10—N2—C6—C5175.5 (4)
O21—Nd1—O22—C21ii8.7 (8)Nd1—N2—C6—C511.9 (6)
O32—Nd1—O22—C21ii18.5 (9)N1—C5—C6—N27.5 (6)
O12—Nd1—O22—C21ii154.3 (7)C4—C5—C6—N2170.5 (5)
N2—Nd1—O22—C21ii74.5 (8)N1—C5—C6—C7175.1 (5)
N1—Nd1—O22—C21ii128.3 (8)C4—C5—C6—C76.9 (8)
O11—Nd1—O22—C21ii130.5 (7)N2—C6—C7—C82.7 (8)
C11—Nd1—O22—C21ii166.2 (7)C5—C6—C7—C8174.6 (5)
Nd1—O21—C21—O22ii117.0 (7)C6—C7—C8—C91.5 (9)
Nd1—O21—C21—C2264.5 (9)C7—C8—C9—C100.5 (9)
O22ii—C21—C22—Cl2263.6 (6)C6—N2—C10—C90.1 (8)
O21—C21—C22—Cl22117.7 (5)Nd1—N2—C10—C9172.8 (5)
O22ii—C21—C22—Cl2158.6 (6)C8—C9—C10—N21.3 (9)
O21—C21—C22—Cl21120.0 (4)
Symmetry codes: (i) x+1, y, z; (ii) x, y, z.
 

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