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Information card for entry 7708632
Preview
| Coordinates | 7708632.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C32 H35 N P2 |
|---|---|
| Calculated formula | C32 H35 N P2 |
| SMILES | P(N(P(c1ccc(cc1)C)c1ccc(cc1)C)C1CCC1)(c1ccc(cc1)C)c1ccc(cc1)C |
| Title of publication | New approach for the synthesis of water soluble fac-[MI(CO)3]+ bis(diarylphosphino)alkylamine complexes (M=99Tc, Re) |
| Authors of publication | Kama, Dumisani Vincent; Frei, Angelo; Brink, Alice; Braband, Henrik; Alberto, Roger; Roodt, Andreas |
| Journal of publication | Dalton Transactions |
| Year of publication | 2021 |
| a | 11.4833 ± 0.0012 Å |
| b | 12.0246 ± 0.0013 Å |
| c | 12.2349 ± 0.0013 Å |
| α | 64.285 ± 0.005° |
| β | 81.986 ± 0.005° |
| γ | 68.172 ± 0.005° |
| Cell volume | 1412.5 ± 0.3 Å3 |
| Cell temperature | 106 ± 2 K |
| Ambient diffraction temperature | 106 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0442 |
| Residual factor for significantly intense reflections | 0.038 |
| Weighted residual factors for significantly intense reflections | 0.0998 |
| Weighted residual factors for all reflections included in the refinement | 0.1038 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.045 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 270125 (current) | 2021-10-29 | cif/ Adding structures of 7708632, 7708633, 7708634, 7708635 via cif-deposit CGI script. |
7708632.cif |
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Users of the data should acknowledge the original authors of the
structural data.