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CIF Information Card
Information card for 7015552
7015551 << 7015552 >> 7015553Preview
|
Coordinates |
7015552.cif |
Structure parameters
| Formula | - C14 H22 B K N6 O S2 - |
| Calculated formula | - C14 H22 B K N6 O S2 - |
| 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 | 6.9487 ± 0.0014 Å |
| b | 37.295 ± 0.008 Å |
| c | 14.782 ± 0.003 Å |
| α | 90° |
| β | 94.1 ± 0.03° |
| γ | 90° |
| Cell volume | 3821 ± 1.4 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 7 |
| Hermann-Mauguin symmetry space group | P 1 21/c 1 |
| Hall symmetry space group | -P 2ybc |
| Residual factor for all reflections | 0.0571 |
| Residual factor for observed reflections | 0.0505 |
| Weighted residual factors for the observed reflections | 0.1036 |
| Weighted residual factors for all reflections included in the refinement | 0.1065 |
| Goodness-of-fit parameter for observed reflections | 1.195 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |