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Information card for entry 2010529
Preview
Coordinates | 2010529.cif |
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Structure factors | 2010529.hkl |
Original IUCr paper | HTML |
Chemical name | trans-[hydrotetrakis(trimethylphosphine)Rhodiumchloride/bromide] [(tetrabromobenzene-1,2-diolato)borate] dichloromethane solvate |
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Formula | C25 H39 B Br8.27 Cl2.73 O4 P4 Rh |
Calculated formula | C25 H39 B Br8.26 Cl2.74 O4 P4 Rh |
Title of publication | Compositional disorder in <i>trans</i>-[RhBr~0.26~Cl~0.74~H(PMe~3~)~4~][B(1,2-O~2~C~6~Br~4~)]·CH~2~Cl~2~ |
Authors of publication | Norman, Nicholas C.; Orpen, A. Guy; Quayle, Michael J.; Robins, Edward G. |
Journal of publication | Acta Crystallographica Section C |
Year of publication | 2000 |
Journal volume | 56 |
Journal issue | 1 |
Pages of publication | 50 - 52 |
a | 13.014 ± 0.0009 Å |
b | 16.399 ± 0.0015 Å |
c | 20.726 ± 0.003 Å |
α | 90 ± 0.008° |
β | 90 ± 0.01° |
γ | 90 ± 0.009° |
Cell volume | 4423.3 ± 0.8 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 8 |
Space group number | 19 |
Hermann-Mauguin space group symbol | P 21 21 21 |
Hall space group symbol | P 2ac 2ab |
Residual factor for all reflections | 0.0703 |
Residual factor for significantly intense reflections | 0.0486 |
Weighted residual factors for all reflections | 0.1184 |
Weighted residual factors for all reflections included in the refinement | 0.1126 |
Goodness-of-fit parameter for all reflections | 1.031 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.154 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2010529.html
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