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Information card for entry 7121713
Preview
Coordinates | 7121713.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C14 H18 Cu3 O15 P2 |
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Calculated formula | C14 H18 Cu3 O15 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 | 8.872 ± 0.002 Å |
b | 9.054 ± 0.003 Å |
c | 13.255 ± 0.004 Å |
α | 90° |
β | 102.344 ± 0.006° |
γ | 90° |
Cell volume | 1040.1 ± 0.5 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 5 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0323 |
Residual factor for significantly intense reflections | 0.0256 |
Weighted residual factors for significantly intense reflections | 0.0549 |
Weighted residual factors for all reflections included in the refinement | 0.0565 |
Goodness-of-fit parameter for all reflections included in the refinement | 1 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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