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Information card for entry 4030248
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| Coordinates | 4030248.cif |
|---|
| Formula | C36 H31 Cl2 Mo N2 O4 P3 |
|---|---|
| Calculated formula | C36 Cl2 Mo N2 O4 P3 |
| SMILES | [Mo]1(Cl)(Cl)([O]=P(N=P(N=P(O1)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)(=O)=O |
| Title of publication | Preparation of hexaphenyldiimidotriphosphinic acid and its adduct with MoO2Cl2 |
| Authors of publication | Roesky, H. W.; Raubold, T.; Witt, M.; Noltemeyer, M. |
| Journal of publication | European Journal of Solid State and Inorganic Chemistry |
| Year of publication | 1989 |
| Journal volume | 26 |
| Pages of publication | 465 - 474 |
| a | 9.141 ± 0.002 Å |
| b | 23.182 ± 0.005 Å |
| c | 17.129 ± 0.003 Å |
| α | 90° |
| β | 102.89 ± 0.03° |
| γ | 90° |
| Cell volume | 3538.3 ± 1.3 Å3 |
| Ambient diffraction temperature | 293 K |
| Number of distinct elements | 7 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for significantly intense reflections | 0.031 |
| Weighted residual factors for significantly intense reflections | 0.043 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178481 (current) | 2016-03-21 | cif/4/03/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/03/02. |
4030248.cif |
| 127885 | 2014-11-25 | cif/ Adding structures of 4030248 via cif-deposit CGI script. |
4030248.cif |
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