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Information card for entry 4065274
Preview
Coordinates | 4065274.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C46 H50 B N7 P S Y |
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Calculated formula | C46 H50 B N7 P S Y |
SMILES | [Y]1234567([S]=C(P(c8ccccc8)c8ccccc8)N1c1ccccc1)([n]1n([BH](n4[n]2c(cc4C)C)n2[n]3c(cc2C)C)c(cc1C)C)[cH]1[cH]4[cH]7[cH]6[cH]51.c1ccccc1C |
Title of publication | Insertion of Isocyanate and Isothiocyanate into the Ln‒P σ-Bond of Organolanthanide Phosphides |
Authors of publication | Yi, Weiyin; Zhang, Jie; Hong, Longcheng; Chen, Zhenxia; Zhou, Xigeng |
Journal of publication | Organometallics |
Year of publication | 2011 |
Journal volume | 30 |
Journal issue | 21 |
Pages of publication | 5809 |
a | 11.212 ± 0.004 Å |
b | 13.638 ± 0.005 Å |
c | 16.428 ± 0.006 Å |
α | 76.376 ± 0.005° |
β | 82.472 ± 0.005° |
γ | 66.392 ± 0.005° |
Cell volume | 2235.1 ± 1.4 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 7 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1384 |
Residual factor for significantly intense reflections | 0.0654 |
Weighted residual factors for significantly intense reflections | 0.1499 |
Weighted residual factors for all reflections included in the refinement | 0.1762 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.907 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Duplicate of | 4065273 |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4065274.html
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Users of the data should acknowledge the original authors of the
structural data.