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Information card for entry 7216371
Preview
Coordinates | 7216371.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C78 H78 Cl2 Mn N12 O8 |
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Calculated formula | C78 H78 Cl2 Mn N12 O8 |
Title of publication | Preparation, crystal structures and conformations of six complexes based on 1,4-bis(benzimidazol-1-ylmethyl)-2,3,5,6-tetramethylbenzene |
Authors of publication | Liu, Qing-Xiang; Zhao, Zhi-Xiang; Zhao, Xiao-Jun; Bi, Yue; Yu, Jie; Wang, Xiu-Guang |
Journal of publication | CrystEngComm |
Year of publication | 2014 |
Journal volume | 16 |
Journal issue | 30 |
Pages of publication | 7023 |
a | 13.4688 ± 0.0012 Å |
b | 13.4688 ± 0.0012 Å |
c | 10.4961 ± 0.0013 Å |
α | 90° |
β | 90° |
γ | 120° |
Cell volume | 1649 ± 0.3 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 6 |
Space group number | 147 |
Hermann-Mauguin space group symbol | P -3 |
Hall space group symbol | -P 3 |
Residual factor for all reflections | 0.0791 |
Residual factor for significantly intense reflections | 0.0478 |
Weighted residual factors for significantly intense reflections | 0.0919 |
Weighted residual factors for all reflections included in the refinement | 0.1039 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.025 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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