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Information card for entry 4512546
Preview
| Coordinates | 4512546.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C38 H36 Cu3 N12 O7 |
|---|---|
| Calculated formula | C38 H36 Cu3 N12 O7 |
| Title of publication | Interaction of the Trinuclear Triangular Secondary Building Unit [Cu3(μ3-OH)(μ-pz)3]2+with 4,4′-Bipyridine. Structural Characterizations of New Coordination Polymers and Hexanuclear CuIIClusters. 2° |
| Authors of publication | Di Nicola, Corrado; Garau, Federica; Gazzano, Massimo; Lanza, Arianna; Monari, Magda; Nestola, Fabrizio; Pandolfo, Luciano; Pettinari, Claudio |
| Journal of publication | Crystal Growth & Design |
| Year of publication | 2015 |
| Journal volume | 15 |
| Journal issue | 3 |
| Pages of publication | 1259 |
| a | 12.705 ± 0.006 Å |
| b | 17.071 ± 0.008 Å |
| c | 19.391 ± 0.01 Å |
| α | 90° |
| β | 98.032 ± 0.004° |
| γ | 90° |
| Cell volume | 4164 ± 4 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.2891 |
| Residual factor for significantly intense reflections | 0.1282 |
| Weighted residual factors for significantly intense reflections | 0.2165 |
| Weighted residual factors for all reflections included in the refinement | 0.2843 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.004 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179672 (current) | 2016-03-24 | cif/4/51/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/51/25. |
4512546.cif |
| 134760 | 2015-04-04 | cif/ Updating files of 4512540, 4512541, 4512542, 4512543, 4512544, 4512545, 4512546 Original log message: Adding full bibliography for 4512540--4512546.cif. |
4512546.cif |
| 129726 | 2015-01-17 | cif/ Adding structures of 4512540, 4512541, 4512542, 4512543, 4512544, 4512545, 4512546 via cif-deposit CGI script. |
4512546.cif |
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Users of the data should acknowledge the original authors of the
structural data.