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Information card for entry 4336664
Preview
| Coordinates | 4336664.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C48 H64 Cu2 N2 P6 |
|---|---|
| Calculated formula | C48 H64 Cu2 N2 P6 |
| Title of publication | Noninnocent Behavior of Bidentate Amidophosphido [NP]2-Ligands upon Coordination to Copper |
| Authors of publication | Mark W. Bezpalko; Bruce M. Foxman; Christine M. Thomas |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2013 |
| Journal volume | 52 |
| Pages of publication | 12329 - 12331 |
| a | 9.3693 ± 0.0007 Å |
| b | 10.585 ± 0.0008 Å |
| c | 14.842 ± 0.001 Å |
| α | 82.895 ± 0.003° |
| β | 82.387 ± 0.003° |
| γ | 79.554 ± 0.004° |
| Cell volume | 1427.27 ± 0.18 Å3 |
| Cell temperature | 120 K |
| Ambient diffraction temperature | 120 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0571 |
| Residual factor for significantly intense reflections | 0.0403 |
| Weighted residual factors for all reflections | 0.0942 |
| Weighted residual factors for significantly intense reflections | 0.0895 |
| Weighted residual factors for all reflections included in the refinement | 0.0942 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301839 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 4/33/ Each referenced PubChem compound corresponds to the full crystal structure. |
4336664.cif |
| 176432 | 2016-02-14 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries. |
4336664.cif |
| 102671 | 2014-02-21 | cif/ Adding structures of 4336664 via cif-deposit CGI script. |
4336664.cif |
All data in the COD and the database itself are dedicated to the
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Users of the data should acknowledge the original authors of the
structural data.