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Information card for entry 4073498
Preview
Coordinates | 4073498.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C33 H70 B20 Cl2 Ni Rh2 Se6 |
---|---|
Calculated formula | C33 H68 B20 Cl2 Ni Rh2 Se6 |
SMILES | [BH]1234[BH]567[C]89%101[BH]1%11%12[BH]%13%14%15[C]281([BH]14%13[BH]235[BH]3%141[BH]1%12%15[BH]6%10%11[BH]7231)[Se][Rh]12345([c]6([c]4([c]3([c]2([c]16C)C)C)C)C)[Se]9[Ni]1([Se]5CCCC)[Se]2[C]3456[BH]789[BH]%10%113[BH]3%124[BH]4%135[BH]5%14%15[BH]%1634[BH]3%10%12[BH]48%11[BH]9%14([C]67%135[Se][Rh]56782([c]2([c]8([c]7([c]6([c]52C)C)C)C)C)[Se]1CCCC)[BH]%15%1634.C(Cl)Cl |
Title of publication | Trinuclear Rh2M Complexes (M = Ni, Pd) Bridged by Butyl Selenolato and Carborane Diselenolato Ligands |
Authors of publication | Cai, Shuyi; Jin, Guo-Xin |
Journal of publication | Organometallics |
Year of publication | 2007 |
Journal volume | 26 |
Journal issue | 22 |
Pages of publication | 5442 |
a | 11.488 ± 0.003 Å |
b | 21.292 ± 0.005 Å |
c | 23.703 ± 0.006 Å |
α | 90° |
β | 100.899 ± 0.004° |
γ | 90° |
Cell volume | 5693 ± 2 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 298 ± 2 K |
Number of distinct elements | 7 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0967 |
Residual factor for significantly intense reflections | 0.0424 |
Weighted residual factors for significantly intense reflections | 0.082 |
Weighted residual factors for all reflections included in the refinement | 0.0923 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.791 |
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/4073498.html
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