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Information card for entry 4078586
Preview
Coordinates | 4078586.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C36 H60 N4 O P Y |
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Calculated formula | C36 H60 N4 O P Y |
SMILES | [Y]123([N](=C(C)C=C(N1CC[N]2(C)C)C)c1c(cccc1C(C)C)C(C)C)(Nc1c(cccc1C(C)C)C(C)C)[O]=P(C)(C)C3 |
Title of publication | C‒P or C‒H Bond Cleavage of Phosphine Oxides Mediated by an Yttrium Hydride |
Authors of publication | Lu, Erli; Chen, Yaofeng; Zhou, Jiliang; Leng, Xuebing |
Journal of publication | Organometallics |
Year of publication | 2012 |
Journal volume | 31 |
Journal issue | 12 |
Pages of publication | 4574 |
a | 11.2506 ± 0.0013 Å |
b | 19.462 ± 0.002 Å |
c | 17.509 ± 0.002 Å |
α | 90° |
β | 91.841 ± 0.002° |
γ | 90° |
Cell volume | 3831.8 ± 0.7 Å3 |
Cell temperature | 133 ± 2 K |
Ambient diffraction temperature | 133 ± 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 | 0.0691 |
Residual factor for significantly intense reflections | 0.0369 |
Weighted residual factors for significantly intense reflections | 0.0859 |
Weighted residual factors for all reflections included in the refinement | 0.0967 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.994 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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