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Information card for entry 4085870
Preview
Coordinates | 4085870.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | (SiNN)Rh(COE) |
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Formula | C31 H43 N2 Rh Si |
Calculated formula | C31 H43 N2 Rh Si |
SMILES | [Rh]123([H][Si](c4cc(ccc4N1c1c4[n]2cccc4cc(c1)C)C)(C(C)C)C(C)C)[CH]1=[CH]3CCCCCC1 |
Title of publication | Adaptability of the SiNN Pincer Ligand in Iridium and Rhodium Complexes Relevant to Borylation Catalysis |
Authors of publication | Lee, Chun-I; Hirscher, Nathanael A.; Zhou, Jia; Bhuvanesh, Nattamai; Ozerov, Oleg V. |
Journal of publication | Organometallics |
Year of publication | 2015 |
Journal volume | 34 |
Journal issue | 13 |
Pages of publication | 3099 |
a | 13.2282 ± 0.0018 Å |
b | 7.2984 ± 0.0009 Å |
c | 28.596 ± 0.004 Å |
α | 90° |
β | 99.75 ± 0.007° |
γ | 90° |
Cell volume | 2720.9 ± 0.6 Å3 |
Cell temperature | 110 ± 2 K |
Ambient diffraction temperature | 110 ± 2 K |
Number of distinct elements | 5 |
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 | 0.0517 |
Residual factor for significantly intense reflections | 0.0446 |
Weighted residual factors for significantly intense reflections | 0.1107 |
Weighted residual factors for all reflections included in the refinement | 0.1142 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.165 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4085870.html
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