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Information card for entry 4069102
Preview
Coordinates | 4069102.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C52 H91 Ru4 Si Y |
---|---|
Calculated formula | C52 H91 Ru4 Si Y |
SMILES | [Y]123456789%10([RuH2]%11%12%13%14([H]6)([H]7)[c]6([c]%12([c]%11([c]%13([c]%146C)C)C)C)C)([Ru]67%11%12%13%14%15%16([H]8)([Ru]8%17%18%19%20%211([H]9)([H]%10%14)([Ru]19%10%146([H]%15)([H]8)([H]%16%21)[c]6([c]1([c]9([c]%10([c]%146C)C)C)C)C)[c]1([c]%17([c]%18([c]%19([c]%201C)C)C)C)C)[c]1([c]7([c]%11([c]%12([c]%131C)C)C)C)C)[c]1([Si](C)(C)C)[c]2([c]3([c]4([c]51C)C)C)C |
Title of publication | Rare Earth/d-Transition Metal Heteromultimetallic Polyhydride Complexes Based on Half-Sandwich Rare Earth Moieties |
Authors of publication | Shima, Takanori; Hou, Zhaomin |
Journal of publication | Organometallics |
Year of publication | 2009 |
Journal volume | 28 |
Journal issue | 7 |
Pages of publication | 2244 |
a | 14.4518 ± 0.001 Å |
b | 19.9079 ± 0.0013 Å |
c | 18.7401 ± 0.0012 Å |
α | 90° |
β | 102.425 ± 0.001° |
γ | 90° |
Cell volume | 5265.3 ± 0.6 Å3 |
Cell temperature | 163 ± 2 K |
Ambient diffraction temperature | 163 ± 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 | 0.0293 |
Residual factor for significantly intense reflections | 0.0219 |
Weighted residual factors for significantly intense reflections | 0.0509 |
Weighted residual factors for all reflections included in the refinement | 0.0523 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.975 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4069102.html
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Users of the data should acknowledge the original authors of the
structural data.