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Information card for entry 7205163
Preview
Coordinates | 7205163.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C38 H46 Hg3 I4 N6 |
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Calculated formula | C38 H46 Hg3 I4 N6 |
SMILES | [Hg](I)(I)([I-])[I-].[Hg]1C(C#N)[Hg]=C2N(CCCC)c3ccccc3N2Cc2c(c(c(c(c2C)C)CN2c3ccccc3N(C=12)CCCC)C)C.N#CC |
Title of publication | N-Heterocyclic carbene copper(i), mercury(ii) and silver(i) complexes containing durene linker: synthesis and structural studies |
Authors of publication | Liu, Qing-Xiang; Chen, Ai-Hui; Zhao, Xiao-Jun; Zang, Yan; Wu, Xiu-Mei; Wang, Xiu-Guang; Guo, Jian-Hua |
Journal of publication | CrystEngComm |
Year of publication | 2011 |
Journal volume | 13 |
Journal issue | 1 |
Pages of publication | 293 |
a | 12.2129 ± 0.0008 Å |
b | 13.3117 ± 0.0008 Å |
c | 16.6923 ± 0.001 Å |
α | 71.161 ± 0.001° |
β | 75.701 ± 0.001° |
γ | 62.988 ± 0.001° |
Cell volume | 2271.9 ± 0.2 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 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 | 0.0481 |
Residual factor for significantly intense reflections | 0.0383 |
Weighted residual factors for significantly intense reflections | 0.0978 |
Weighted residual factors for all reflections included in the refinement | 0.1043 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.03 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7205163.html
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