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Information card for entry 7022974
Preview
Coordinates | 7022974.cif |
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Original paper (by DOI) | HTML |
Formula | C24 H27 Br Cl N2 O7 Rh |
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Calculated formula | C24 H27 Br Cl N2 O7 Rh |
SMILES | [Rh]12345([c]6([c]71[c]2([cH]3[c]46OCC)CCCC7)C(=O)OCC)([n]1c(c2[n]5cccc2)cccc1)Br.Cl(=O)(=O)(=O)[O-] |
Title of publication | Functionalized cyclopentadienyl rhodium(III) bipyridine complexes: synthesis, characterization, and catalytic application in hydrogenation of ketones. |
Authors of publication | Wang, Wan-Hui; Suna, Yuki; Himeda, Yuichiro; Muckerman, James T.; Fujita, Etsuko |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2013 |
Journal volume | 42 |
Journal issue | 26 |
Pages of publication | 9628 - 9636 |
a | 14.9471 ± 0.0008 Å |
b | 10.5506 ± 0.0006 Å |
c | 16.8312 ± 0.001 Å |
α | 90° |
β | 95.793 ± 0.001° |
γ | 90° |
Cell volume | 2640.7 ± 0.3 Å3 |
Cell temperature | 293 K |
Ambient diffraction temperature | 293 K |
Number of distinct elements | 7 |
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 | 0.0676 |
Residual factor for significantly intense reflections | 0.0369 |
Weighted residual factors for all reflections | 0.0583 |
Weighted residual factors for significantly intense reflections | 0.0429 |
Weighted residual factors for all reflections included in the refinement | 0.0429 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.0887 |
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/7022974.html
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