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Information card for entry 7121714
Preview
Coordinates | 7121714.cif |
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Original paper (by DOI) | HTML |
Formula | C14 H12 Cu3 O12 P2 |
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Calculated formula | C14 H12 Cu3 O12 P2 |
Title of publication | Temperature controlled formation of polar copper phosphonates showing large dielectric anisotropy and a dehydration-induced switch from ferromagnetic to antiferromagnetic interactions. |
Authors of publication | Wang, Peng-Fei; Bao, Song-Song; Huang, Xin-Da; Akutagawa, T.; Zheng, Li-Min |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2018 |
Journal volume | 54 |
Journal issue | 49 |
Pages of publication | 6276 - 6279 |
a | 22.65 ± 0.003 Å |
b | 8.8845 ± 0.0011 Å |
c | 8.9245 ± 0.0011 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1795.9 ± 0.4 Å3 |
Cell temperature | 123 ± 2 K |
Ambient diffraction temperature | 123 ± 2 K |
Number of distinct elements | 5 |
Space group number | 60 |
Hermann-Mauguin space group symbol | P b c n |
Hall space group symbol | -P 2n 2ab |
Residual factor for all reflections | 0.0494 |
Residual factor for significantly intense reflections | 0.0334 |
Weighted residual factors for significantly intense reflections | 0.0721 |
Weighted residual factors for all reflections included in the refinement | 0.0774 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.004 |
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/7121714.html
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