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Information card for entry 7118449
Preview
| Coordinates | 7118449.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C44 H63 Cl3 N2 O0.5 P2 |
|---|---|
| Calculated formula | C44 H63 Cl3 N2 O0.5 P2 |
| Title of publication | [((Cl)Im(Dipp))P[double bond, length as m-dash]P(Dipp)][GaCl4]: a polarized, cationic diphosphene. |
| Authors of publication | Schwedtmann, Kai; Holthausen, Michael H.; Sala, Chris H.; Hennersdorf, Felix; Fröhlich, Roland; Weigand, Jan J. |
| Journal of publication | Chemical communications (Cambridge, England) |
| Year of publication | 2016 |
| Journal volume | 52 |
| Journal issue | 7 |
| Pages of publication | 1409 - 1412 |
| a | 27.4838 ± 0.0003 Å |
| b | 17.6558 ± 0.0002 Å |
| c | 21.9216 ± 0.0003 Å |
| α | 90° |
| β | 118.269 ± 0.001° |
| γ | 90° |
| Cell volume | 9368.7 ± 0.2 Å3 |
| Cell temperature | 153 ± 2 K |
| Ambient diffraction temperature | 153 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0591 |
| Residual factor for significantly intense reflections | 0.0522 |
| Weighted residual factors for significantly intense reflections | 0.1579 |
| Weighted residual factors for all reflections included in the refinement | 0.1655 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.051 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301857 (current) | 2025-08-22 | Add cross-references to PubChem compounds in COD range 7/11/ Each referenced PubChem compound corresponds to the full crystal structure. |
7118449.cif |
| 174469 | 2016-01-15 | cif/ Adding structures of 7118449, 7118450, 7118451, 7118452 via cif-deposit CGI script. |
7118449.cif |
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Users of the data should acknowledge the original authors of the
structural data.