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Information card for entry 4070921
Preview
Coordinates | 4070921.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C17 H30 B10 Co N S2 |
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Calculated formula | C17 H30 B10 Co N S2 |
SMILES | [Co]12345([n]6c(S1)cccc6)(S[C]1678[BH]9%10%11[BH]%12%131[BH]1%146[BH]6%157[BH]7%16%17[BH]%189([BH]9%10%12[BH]%10%131[BH]%1467[BH]%16%189%10)[CH]8%11%15%17)[c]1([c]5([c]4([c]3([c]21C)C)C)C)C |
Title of publication | Synthesis and Structure of Half-Sandwich Pyridine-2-thiolato Cobalt(III) and Rhodium(III) Complexes and Their Reactivity toward Monodentate or Bidentate 1,2-Dicarba-closo-dodecaborane Thiolate Ligands |
Authors of publication | Liu, Shu; Wang, Hui; Zhang, Peng-Cheng; Weng, Lin-Hong; Hou, Xiu-Feng |
Journal of publication | Organometallics |
Year of publication | 2008 |
Journal volume | 27 |
Journal issue | 4 |
Pages of publication | 713 |
a | 14.608 ± 0.009 Å |
b | 12.793 ± 0.008 Å |
c | 26.283 ± 0.016 Å |
α | 90° |
β | 94.7 ± 0.01° |
γ | 90° |
Cell volume | 4895 ± 5 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
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 | 0.1533 |
Residual factor for significantly intense reflections | 0.0601 |
Weighted residual factors for significantly intense reflections | 0.1212 |
Weighted residual factors for all reflections included in the refinement | 0.1457 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.778 |
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/4070921.html
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Users of the data should acknowledge the original authors of the
structural data.