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Information card for entry 7700021
Preview
| Coordinates | 7700021.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | [{NbOCl3(DEPE)2}(DEPE)] |
|---|---|
| Formula | C30 H72 Cl6 Nb2 O2 P6 |
| Calculated formula | C30 H72 Cl6 Nb2 O2 P6 |
| Title of publication | Niobium tetrahalide complexes with neutral diphosphine ligands |
| Authors of publication | Benjamin, Sophie L.; Chang, Yao-Pang; Hector, Andrew L.; Jura, Marek; Levason, William; Reid, Gillian; Stenning, Gavin |
| Journal of publication | Dalton Transactions |
| Year of publication | 2016 |
| Journal volume | 45 |
| Journal issue | 19 |
| Pages of publication | 8192 - 8200 |
| a | 9.8162 ± 0.0003 Å |
| b | 11.6449 ± 0.0003 Å |
| c | 20.2185 ± 0.0014 Å |
| α | 90° |
| β | 95.496 ± 0.007° |
| γ | 90° |
| Cell volume | 2300.53 ± 0.19 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 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 | 0.0358 |
| Residual factor for significantly intense reflections | 0.0288 |
| Weighted residual factors for significantly intense reflections | 0.0637 |
| Weighted residual factors for all reflections included in the refinement | 0.0665 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.072 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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