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CIF Information Card
Information card for 1100723
1100722 << 1100723 >> 1100724Preview
|
Coordinates |
1100723.cif |
Structure parameters
| Common name | C40.50 H18 Fe3 N3 O16 |
| Formula | - C40.5 H18 Fe3 N3 O16 - |
| Calculated formula | - C40.5 H18 Fe3 N3 O16 - |
| Title of publication | Metal-Organic Frameworks Based on Trigonal Prismatic Building Blocks and the New "acs" Topology |
| Authors of publication | Andrea C. Sudik; Adrien P. Côté; Omar M. Yaghi |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2005 |
| Journal volume | 44 |
| Pages of publication | 2998 - 3000 |
| a | 13.01 ± 0.004 Å |
| b | 13.01 ± 0.004 Å |
| c | 14.874 ± 0.009 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 2180.3 ± 1.6 Å3 |
| Cell temperature | 153 ± 2 K |
| Ambient diffraction temperature | 153 ± 2 K |
| Number of distinct elements | 5 |
| Hermann-Mauguin symmetry space group | P -6 2 c |
| Hall symmetry space group | P -6c -2c |
| Residual factor for all reflections | 0.1382 |
| Residual factor for observed reflections | 0.0651 |
| Weighted residual factors for the observed reflections | 0.1039 |
| Weighted residual factors for all reflections included in the refinement | 0.1193 |
| Goodness-of-fit parameter for observed reflections | 1.004 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |