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Information card for entry 7054764
Preview
Coordinates | 7054764.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C30 H47 N3 P Sc |
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Calculated formula | C30 H47 N3 P Sc |
SMILES | [Sc]12(Pc3c(cccc3C)C)([N](=C(C)C=C(N1CC[N]2(C)C)C)c1c(cccc1C(C)C)C(C)C)C |
Title of publication | Substitution reaction of triphenylphosphine oxide with rare-earth metal phosphido methyl complexes |
Authors of publication | Lv, Yingdong; Zhou, Jiliang; Leng, Xuebing; Chen, Yaofeng |
Journal of publication | New J. Chem. |
Year of publication | 2015 |
Journal volume | 39 |
Journal issue | 10 |
Pages of publication | 7582 |
a | 10.7097 ± 0.0015 Å |
b | 13.537 ± 0.002 Å |
c | 20.887 ± 0.003 Å |
α | 90° |
β | 93.806 ± 0.003° |
γ | 90° |
Cell volume | 3021.5 ± 0.8 Å3 |
Cell temperature | 133 ± 2 K |
Ambient diffraction temperature | 133 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.1183 |
Residual factor for significantly intense reflections | 0.0728 |
Weighted residual factors for significantly intense reflections | 0.1917 |
Weighted residual factors for all reflections included in the refinement | 0.2312 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.041 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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