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Information card for entry 7246243
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Coordinates | 7246243.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C78 H46 Cd3 N8 O12 |
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Calculated formula | C78 H46 Cd3 N8 O12 |
Title of publication | Two-dimensional Cd3-based metal–organic frameworks with halogen bonding sites for the uptake of I2 |
Authors of publication | Zhang, Zhi-Hao; Ge, Jia-Lu; Li, Yan; Li, Qing; Ma, Pin-Pin; Tang, Xiao-Yan; Zhang, Wen-Hua; Young, David J. |
Journal of publication | CrystEngComm |
Year of publication | 2023 |
Journal volume | 25 |
Journal issue | 12 |
Pages of publication | 1775 - 1781 |
a | 12.986 ± 0.006 Å |
b | 13 ± 0.007 Å |
c | 13.638 ± 0.007 Å |
α | 78.032 ± 0.008° |
β | 78.169 ± 0.007° |
γ | 80.196 ± 0.007° |
Cell volume | 2184.7 ± 1.9 Å3 |
Cell temperature | 213 ± 2 K |
Ambient diffraction temperature | 213 ± 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 | 0.2405 |
Residual factor for significantly intense reflections | 0.1034 |
Weighted residual factors for significantly intense reflections | 0.2081 |
Weighted residual factors for all reflections included in the refinement | 0.2376 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.047 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7246243.html
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