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Information card for entry 7038617
Preview
Coordinates | 7038617.cif |
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Original paper (by DOI) | HTML |
Formula | C24 H32 Cl Mn N4 O8 |
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Calculated formula | C24 H32 Cl Mn N4 O8 |
Title of publication | Structural insights into the counterion effects on the manganese(iii) spin crossover system with hexadentate Schiff-base ligands. |
Authors of publication | Wang, Shi; Xu, Wu-Tan; He, Wen-Rui; Takaishi, Shinya; Li, Yong-Hua; Yamashita, Masahiro; Huang, Wei |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2016 |
Journal volume | 45 |
Journal issue | 13 |
Pages of publication | 5676 - 5688 |
a | 17.778 ± 0.004 Å |
b | 8.5035 ± 0.0017 Å |
c | 17.534 ± 0.004 Å |
α | 90° |
β | 96.61 ± 0.03° |
γ | 90° |
Cell volume | 2633.1 ± 1 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 6 |
Space group number | 13 |
Hermann-Mauguin space group symbol | P 1 2/c 1 |
Hall space group symbol | -P 2yc |
Residual factor for all reflections | 0.1171 |
Residual factor for significantly intense reflections | 0.0985 |
Weighted residual factors for significantly intense reflections | 0.2071 |
Weighted residual factors for all reflections included in the refinement | 0.2181 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.126 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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