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Information card for entry 7234893
Preview
| Coordinates | 7234893.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C100 H52 Cu4 N32 |
|---|---|
| Calculated formula | C100 H52 Cu4 N32 |
| Title of publication | Supramolecular self-assembled coordination architecture composed of a doubly bis(2-pyridyl)pyrazolate bridged dinuclear CuII complex and 7,7′,8,8′,-tetracyano-p-quinodimethanide radicals |
| Authors of publication | Ishikawa, Ryuta; Ueno, Shunya; Iguchi, Hiroaki; Breedlove, Brian K.; Yamashita, Masahiro; Kawata, Satoshi |
| Journal of publication | CrystEngComm |
| Year of publication | 2020 |
| Journal volume | 22 |
| Journal issue | 2 |
| Pages of publication | 159 - 163 |
| a | 14.234 ± 0.0013 Å |
| b | 19.8446 ± 0.0019 Å |
| c | 15.452 ± 0.0016 Å |
| α | 90° |
| β | 106.326 ± 0.003° |
| γ | 90° |
| Cell volume | 4188.7 ± 0.7 Å3 |
| Cell temperature | 200 K |
| Ambient diffraction temperature | 200 K |
| Number of distinct elements | 4 |
| 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 | 0.0688 |
| Residual factor for significantly intense reflections | 0.0433 |
| Weighted residual factors for significantly intense reflections | 0.1126 |
| Weighted residual factors for all reflections included in the refinement | 0.1321 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.043 |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301866 (current) | 2025-08-23 | Add cross-references to PubChem compounds in COD range 7/23/ Each referenced PubChem compound corresponds to the full crystal structure. |
7234893.cif |
| 257462 | 2020-10-06 | cif/ Updating files of 7234893 Original log message: Adding full bibliography for 7234893.cif. |
7234893.cif |
| 247674 | 2020-02-04 | cif/ Updating files of 7234893 Original log message: Adding full bibliography for 7234893.cif. |
7234893.cif |
| 220617 | 2019-11-01 | cif/ Adding structures of 7234893 via cif-deposit CGI script. |
7234893.cif |
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Users of the data should acknowledge the original authors of the
structural data.