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CIF Information Card
Information card for 1100140
1100139 << 1100140 >> 1100141Preview
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Coordinates |
1100140.cif |
Structure parameters
| Common name | (Cu3Cl2(OH)3(2-pymo)(4,4'-bpy)1.5)n(NO3)n.6.25nH2O |
| Formula | - C34 H41.5 Cl2 Cu3 N9 O12.25 - |
| Calculated formula | - C34 H27 Cl2 Cu3 N9 O12.25 - |
| Title of publication | Heteroleptic pyrimidine-2-olate and 4,4[prime or minute]-bipyridine copper(II) layered metal-organic frameworks with swelling properties. |
| Authors of publication | Barea, Elisa; Quiros, Miguel; Navarro, Jorge A. R.; Salas, Juan M. |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2005 |
| Journal issue | 9 |
| Pages of publication | 1743 - 1746 |
| a | 17.076 ± 0.003 Å |
| b | 19.341 ± 0.003 Å |
| c | 13.481 ± 0.002 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 4452.3 ± 1.2 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| Hermann-Mauguin symmetry space group | P n n 2 |
| Hall symmetry space group | P 2 -2n |
| Residual factor for all reflections | 0.1154 |
| Residual factor for observed reflections | 0.0841 |
| Weighted residual factors for the observed reflections | 0.201 |
| Weighted residual factors for all reflections included in the refinement | 0.2176 |
| Goodness-of-fit parameter for observed reflections | 1.099 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |