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Information card for entry 4065156
Preview
Coordinates | 4065156.cif |
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Original paper (by DOI) | HTML |
Formula | C23 H48 B N P2 Ru |
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Calculated formula | C23 H48 B N P2 Ru |
SMILES | [RuH]123([P](Cc4[n]2c(ccc4)C[P]1(C(C)(C)C)C(C)(C)C)(C(C)(C)C)C(C)(C)C)[H][BH2][H]3 |
Title of publication | Electron-Rich PNP- and PNN-Type Ruthenium(II) Hydrido Borohydride Pincer Complexes. Synthesis, Structure, and Catalytic Dehydrogenation of Alcohols and Hydrogenation of Esters |
Authors of publication | Zhang, Jing; Balaraman, Ekambaram; Leitus, Gregory; Milstein, David |
Journal of publication | Organometallics |
Year of publication | 2011 |
Journal volume | 30 |
Journal issue | 21 |
Pages of publication | 5716 |
a | 12.541 ± 0.002 Å |
b | 15.314 ± 0.003 Å |
c | 15.131 ± 0.003 Å |
α | 90° |
β | 111.85 ± 0.03° |
γ | 90° |
Cell volume | 2697.2 ± 1 Å3 |
Cell temperature | 120 ± 2 K |
Ambient diffraction temperature | 120 ± 2 K |
Number of distinct elements | 6 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0364 |
Residual factor for significantly intense reflections | 0.0325 |
Weighted residual factors for significantly intense reflections | 0.0742 |
Weighted residual factors for all reflections included in the refinement | 0.0764 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.014 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4065156.html
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