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Information card for entry 7103006
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Coordinates | 7103006.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | cadmium bct |
---|---|
Formula | C6 H6 Cd N2 O5 S3 |
Calculated formula | C6 H6 Cd N2 O5 S3 |
Title of publication | Single-crystal-to-single-crystal transformation involving release of bridging water molecules and conversion of chain helicity in a chiral three-dimensional metal-organic framework. |
Authors of publication | Xue, Dong-Xu; Zhang, Wei-Xiong; Chen, Xiao-Ming; Wang, He-Zhou |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2008 |
Journal issue | 13 |
Pages of publication | 1551 - 1553 |
a | 5.1436 ± 0.0006 Å |
b | 10.1864 ± 0.0012 Å |
c | 20.945 ± 0.003 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1097.4 ± 0.2 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
Space group number | 19 |
Hermann-Mauguin space group symbol | P 21 21 21 |
Hall space group symbol | P 2ac 2ab |
Residual factor for all reflections | 0.0175 |
Residual factor for significantly intense reflections | 0.0172 |
Weighted residual factors for significantly intense reflections | 0.0399 |
Weighted residual factors for all reflections included in the refinement | 0.0401 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.074 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7103006.html
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