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Information card for entry 4081676
Preview
Coordinates | 4081676.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C72 H90 N5 O0 P2 Si0 Y |
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Calculated formula | C78 H96 N5 P2 Y |
SMILES | [Y]12([N](=P(N1c1c(C(C)C)cccc1C(C)C)(c1ccccc1)c1ccccc1)P(=[N]2c1c(C(C)C)cccc1C(C)C)(c1ccccc1)c1ccccc1)(Nc1c(C(C)C)cccc1C(C)C)Nc1c(cccc1C(C)C)C(C)C.c1ccccc1 |
Title of publication | Facile Preparation of a Scandium Terminal Imido Complex Supported by a Phosphazene Ligand |
Authors of publication | Rong, Weifeng; Cheng, Jianhua; Mou, Zehuai; Xie, Hongyan; Cui, Dongmei |
Journal of publication | Organometallics |
Year of publication | 2013 |
Journal volume | 32 |
Journal issue | 19 |
Pages of publication | 5523 |
a | 13.3417 ± 0.0008 Å |
b | 23.5568 ± 0.0013 Å |
c | 22.3531 ± 0.0013 Å |
α | 90° |
β | 94.232 ± 0.001° |
γ | 90° |
Cell volume | 7006.2 ± 0.7 Å3 |
Cell temperature | 273 ± 2 K |
Ambient diffraction temperature | 273 ± 2 K |
Number of distinct elements | 7 |
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 | 0.1006 |
Residual factor for significantly intense reflections | 0.0573 |
Weighted residual factors for significantly intense reflections | 0.1263 |
Weighted residual factors for all reflections included in the refinement | 0.1456 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.996 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4081676.html
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Users of the data should acknowledge the original authors of the
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