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CIF Information Card
Information card for 7205737
7205736 << 7205737 >> 7205738Preview
|
Coordinates |
7205737.cif |
Structure parameters
| Formula | - C96 H84 N18 O38 Zn5 - |
| Calculated formula | - C96 H84 N18 O38 Zn5 - |
| Title of publication | Topological diversity in zinc coordination polymers with 5-substituted isophthalate and bis(4-pyridylmethyl)piperazine ligands |
| Authors of publication | Pochodylo, Amy L.; LaDuca, Robert L. |
| Journal of publication | CrystEngComm |
| Year of publication | 2011 |
| Journal volume | 13 |
| Journal issue | 7 |
| Pages of publication | 2249 |
| a | 9.4905 ± 0.0005 Å |
| b | 12.112 ± 0.0006 Å |
| c | 23.4975 ± 0.0012 Å |
| α | 93.066 ± 0.001° |
| β | 90.284 ± 0.001° |
| γ | 110.117 ± 0.001° |
| Cell volume | 2531.8 ± 0.2 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 5 |
| Hermann-Mauguin symmetry space group | P -1 |
| Hall symmetry space group | -P 1 |
| Residual factor for all reflections | 0.0389 |
| Residual factor for observed reflections | 0.0288 |
| Weighted residual factors for the observed reflections | 0.0675 |
| Weighted residual factors for all reflections included in the refinement | 0.0716 |
| Goodness-of-fit parameter for observed reflections | 1.027 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |