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Information card for entry 7131229
Preview
Coordinates | 7131229.cif |
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Original paper (by DOI) | HTML |
Formula | C29 H28 Fe S2 |
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Calculated formula | C29 H28 Fe S2 |
SMILES | [Fe]12345678([cH]9[cH]1[cH]2[cH]3[cH]49)[c]12[cH]5[cH]6[cH]7[c]81[C@](SC1CCCCC1)(Sc1ccccc1)c1c2cccc1 |
Title of publication | Design and synthesis of a new family of planar and central chiral ferrocenyl phosphine ligands. |
Authors of publication | Ling, Li; Song, Zeli; Shan, He; Wang, Chao; Li, Shouting; Wang, Yanjiao; Hu, Jianfeng; Chen, Qian; Zhang, Hao; Yang, Yong |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2023 |
Journal volume | 59 |
Journal issue | 19 |
Pages of publication | 2739 - 2742 |
a | 8.559 ± 0.005 Å |
b | 11.896 ± 0.006 Å |
c | 23.988 ± 0.013 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 2442 ± 2 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 4 |
Space group number | 19 |
Hermann-Mauguin space group symbol | P 21 21 21 |
Hall space group symbol | P 2ac 2ab |
Residual factor for all reflections | 0.1085 |
Residual factor for significantly intense reflections | 0.0612 |
Weighted residual factors for significantly intense reflections | 0.1484 |
Weighted residual factors for all reflections included in the refinement | 0.1713 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.951 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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