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CIF Information Card
Information card for 7101869
7101868 << 7101869 >> 7101870Preview
|
Coordinates |
7101869.cif |
Structure parameters
| Formula | - C96 H72 Cu3 N30 O30 - |
| Calculated formula | - C96 H72 Cu3 N26 O22 - |
| Title of publication | An unprecedented twofold interpenetrating (3,4)-connected 3-D metal-organic framework. |
| Authors of publication | Hong, Seunghee; Zou, Yang; Moon, Dohyun; Lah, Myoung Soo |
| Journal of publication | Chemical communications (Cambridge, England) |
| Year of publication | 2007 |
| Journal issue | 17 |
| Pages of publication | 1707 - 1709 |
| a | 56.792 ± 0.011 Å |
| b | 14.331 ± 0.003 Å |
| c | 32.17 ± 0.006 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 26183 ± 9 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Hermann-Mauguin symmetry space group | P n n a |
| Hall symmetry space group | -P 2a 2bc |
| Residual factor for all reflections | 0.1664 |
| Residual factor for observed reflections | 0.0787 |
| Weighted residual factors for the observed reflections | 0.1739 |
| Weighted residual factors for all reflections included in the refinement | 0.193 |
| Goodness-of-fit parameter for observed reflections | 0.688 |
| Diffraction radiation wavelength | 0.7 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |