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Information card for entry 4069726
Preview
Coordinates | 4069726.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C45 H62 Ir N2 P Si |
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Calculated formula | C45 H62 Ir N2 P Si |
SMILES | [IrH2]1([Si](c2ccccc2)(c2ccccc2)c2ccccc2)([P](C(C)C)(C(C)C)C(C)C)[n]2c(c3[n]1ccc(c3)C(C)(C)C)cc(cc2)C(C)(C)C |
Title of publication | Synthesis and Reactivity of Iridium and Rhodium Silyl Complexes Supported by a Bipyridine Ligand |
Authors of publication | McBee, Jennifer L.; Tilley, T. Don |
Journal of publication | Organometallics |
Year of publication | 2009 |
Journal volume | 28 |
Journal issue | 17 |
Pages of publication | 5072 |
a | 11.5586 ± 0.0012 Å |
b | 14.1276 ± 0.0015 Å |
c | 14.3364 ± 0.0015 Å |
α | 94.246 ± 0.002° |
β | 104.751 ± 0.001° |
γ | 109.754 ± 0.001° |
Cell volume | 2097.5 ± 0.4 Å3 |
Cell temperature | 151 ± 2 K |
Ambient diffraction temperature | 151 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0263 |
Residual factor for significantly intense reflections | 0.0226 |
Weighted residual factors for significantly intense reflections | 0.0522 |
Weighted residual factors for all reflections included in the refinement | 0.0529 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.022 |
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/4069726.html
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