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Information card for entry 7212250
Preview
Coordinates | 7212250.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C96 H58 Cd2 N8 O12 |
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Calculated formula | C96 H58 Cd2 N8 O12 |
SMILES | [n]12cccc3c1c1[n]([Cd]42([n]2cccc5ccc6ccc[n]4c6c25)(OC(=O)c2c4ccccc4c(C(=O)O[Cd]45([n]6cccc7ccc8ccc[n]4c8c67)([n]4cccc6ccc7ccc[n]5c7c46)OC(=O)c4c5c(c(C(=O)O)c6c4cccc6)cccc5)c4c2cccc4)OC(=O)c2c4c(c(C(=O)O)c5c2cccc5)cccc4)cccc1cc3 |
Title of publication | Cadmium(ii) coordination polymers based on a bulky anthracene-based dicarboxylate ligand: crystal structures and luminescent properties |
Authors of publication | Liu, Chun-Sen; Wang, Jun-Jie; Chang, Ze; Yan, Li-Fen; Bu, Xian-He |
Journal of publication | CrystEngComm |
Year of publication | 2010 |
Journal volume | 12 |
Journal issue | 6 |
Pages of publication | 1833 |
a | 9.7828 ± 0.0009 Å |
b | 12.1306 ± 0.0012 Å |
c | 17.092 ± 0.002 Å |
α | 105.588 ± 0.002° |
β | 99.624 ± 0.002° |
γ | 100.178 ± 0.002° |
Cell volume | 1873 ± 0.3 Å3 |
Cell temperature | 294 ± 2 K |
Ambient diffraction temperature | 294 ± 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 | 0.088 |
Residual factor for significantly intense reflections | 0.0419 |
Weighted residual factors for significantly intense reflections | 0.084 |
Weighted residual factors for all reflections included in the refinement | 0.0955 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.947 |
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/7212250.html
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Users of the data should acknowledge the original authors of the
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