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Information card for entry 8104795
Preview
Coordinates | 8104795.cif |
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Original paper (by DOI) | HTML |
Formula | C22 H22 Cl2 Hg N10 |
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Calculated formula | C22 H22 Cl2 Hg N10 |
Title of publication | Crystal structure of bis{1-[(benzotriazol-1-yl)methyl]-1H-1,3-(2-methyl-imidazol)}di-chloridomercury(II), [Hg(C11H11N5)2Cl2], C22H22N10Cl2Hg |
Authors of publication | Yang, Hai-Yan; Zhao, Yao-Min; Li, Hui; Wang, Hong-Fang; Li, Ying-Hua; He, Fang |
Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
Year of publication | 2021 |
Journal volume | 236 |
Journal issue | 3 |
Pages of publication | 663 - 665 |
a | 8.2034 ± 0.0004 Å |
b | 12.7859 ± 0.0007 Å |
c | 13.5026 ± 0.0007 Å |
α | 66.069 ± 0.005° |
β | 79.964 ± 0.004° |
γ | 84.465 ± 0.004° |
Cell volume | 1274.18 ± 0.13 Å3 |
Cell temperature | 291 ± 2 K |
Ambient diffraction temperature | 291.15 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.05 |
Residual factor for significantly intense reflections | 0.0372 |
Weighted residual factors for significantly intense reflections | 0.0621 |
Weighted residual factors for all reflections included in the refinement | 0.067 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.029 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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