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CIF Information Card
Information card for 7015559
7015558 << 7015559 >> 7015560Preview
|
Coordinates |
7015559.cif |
Structure parameters
| Formula | - C30 H44 B Cl5 Ir2 N6 S3 - |
| Calculated formula | - C30 H44 B Cl5 Ir2 N6 S3 - |
| Title of publication | Potassium S2N-heteroscorpionates: structure and iridaboratrane formation. |
| Authors of publication | López-Gómez, María J; Connelly, Neil G.; Haddow, Mairi F.; Hamilton, Alex; Lusi, Matteo; Baisch, Ulrich; Orpen, A. Guy |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2011 |
| Journal volume | 40 |
| Journal issue | 17 |
| Pages of publication | 4647 - 4659 |
| a | 10.8535 ± 0.0018 Å |
| b | 14.237 ± 0.003 Å |
| c | 14.797 ± 0.003 Å |
| α | 113.731 ± 0.007° |
| β | 91.748 ± 0.007° |
| γ | 108.989 ± 0.007° |
| Cell volume | 1944.5 ± 0.7 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 7 |
| Hermann-Mauguin symmetry space group | P -1 |
| Hall symmetry space group | -P 1 |
| Residual factor for all reflections | 0.0354 |
| Residual factor for observed reflections | 0.0253 |
| Weighted residual factors for the observed reflections | 0.0539 |
| Weighted residual factors for all reflections included in the refinement | 0.0575 |
| Goodness-of-fit parameter for observed reflections | 1.03 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |