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Information card for entry 2104894
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Coordinates | 2104894.cif |
---|---|
Original IUCr paper | HTML |
Chemical name | catena-tetrakis(imidazole)-tetrakis(μ~2~-oxo)-dioxo-manganese(ii)-di-vanadium |
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Formula | C12 H16 Mn N8 O6 V2 |
Calculated formula | C12 H16 Mn N8 O6 V2 |
Title of publication | Investigation of the structure and phase transitions of the polymeric inorganic‒organic hybrids: [<i>M</i>(Im)~4~V~2~O~6~]~{∞~}; <i>M</i> = Mn, Co, Ni, Im = imidazole |
Authors of publication | Chainok, Kittipong; Haller, Kenneth J.; Rae, A. David; Willis, Anthony C.; Williams, Ian D. |
Journal of publication | Acta Crystallographica Section B |
Year of publication | 2011 |
Journal volume | 67 |
Journal issue | 1 |
Pages of publication | 41 - 52 |
a | 16.3271 ± 0.0002 Å |
b | 16.3271 ± 0.0002 Å |
c | 14.8304 ± 0.0002 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 3953.4 ± 0.09 Å3 |
Cell temperature | 283 ± 2 K |
Ambient diffraction temperature | 283 ± 2 K |
Number of distinct elements | 6 |
Space group number | 86 |
Hermann-Mauguin space group symbol | P 42/n :2 |
Hall space group symbol | -P 4bc |
Residual factor for all reflections | 0.0644 |
Residual factor for significantly intense reflections | 0.0478 |
Weighted residual factors for all reflections included in the refinement | 0.0746 |
Goodness-of-fit parameter for all reflections | 2.5912 |
Goodness-of-fit parameter for all reflections included in the refinement | 2.5912 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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