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Information card for entry 4323832
Preview
Coordinates | 4323832.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C31 H44 Cd2 Cl6 N15 P3 |
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Calculated formula | C31 H44 Cd2 Cl6 N15 P3 |
SMILES | [Cd]12(Cl)(Cl)[N]3=P4([N]([Cd](Cl)(Cl)([n]5n4c(cc5C)C)[n]4n5c(cc4C)C)=P5(N=P3(n3[n]2c(cc3C)C)n2nc(cc2C)C)n2nc(cc2C)C)n2[n]1c(cc2C)C.ClCCl |
Title of publication | Mono- and Dinuclear d10 Metal Complexes of Hexakis(3,5-dimethylpyrazolyl)cyclotriphosphazene. Synthesis, Structures, and Unusual Solution Dynamic Behavior |
Authors of publication | Younghun Byun; Dongwon Min; Junghwan Do; Hoseop Yun; Youngkyu Do |
Journal of publication | Inorganic Chemistry |
Year of publication | 1996 |
Journal volume | 35 |
Pages of publication | 3981 - 3989 |
a | 18.585 ± 0.005 Å |
b | 17.585 ± 0.004 Å |
c | 14.404 ± 0.003 Å |
α | 90° |
β | 102.71 ± 0.02° |
γ | 90° |
Cell volume | 4592.1 ± 1.9 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0421 |
Residual factor for significantly intense reflections | 0.0365 |
Weighted residual factors for all reflections | 0.095 |
Weighted residual factors for significantly intense reflections | 0.0886 |
Goodness-of-fit parameter for all reflections | 1.055 |
Goodness-of-fit parameter for significantly intense reflections | 1.053 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKa |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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