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CIF Information Card
Information card for 7101843
7101842 << 7101843 >> 7101844Preview
|
Coordinates |
7101843.cif |
Structure parameters
| Formula | - C157 H141 Mn14 N14 O50 Sr - |
| Calculated formula | - C133 H105 Mn14 N2 O50 Sr - |
| Title of publication | Heteronuclear Mn-Ca/Sr complexes, and Ca/Sr EXAFS spectral comparisons with the oxygen-evolving complex of photosystem II. |
| Authors of publication | Mishra, Abhudaya; Yano, Junko; Pushkar, Yulia; Yachandra, Vittal K; Abboud, Khalil A; Christou, George |
| Journal of publication | Chemical communications (Cambridge, England) |
| Year of publication | 2007 |
| Journal issue | 15 |
| Pages of publication | 1538 - 1540 |
| a | 18.4417 ± 0.0016 Å |
| b | 19.043 ± 0.0016 Å |
| c | 25.447 ± 0.002 Å |
| α | 69.789 ± 0.002° |
| β | 78.549 ± 0.002° |
| γ | 73.792 ± 0.002° |
| Cell volume | 8001.2 ± 1.2 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 6 |
| Hermann-Mauguin symmetry space group | P -1 |
| Hall symmetry space group | -P 1 |
| Residual factor for all reflections | 0.2011 |
| Residual factor for observed reflections | 0.0896 |
| Weighted residual factors for the observed reflections | 0.2069 |
| Weighted residual factors for all reflections included in the refinement | 0.2247 |
| Goodness-of-fit parameter for observed reflections | 1.001 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |