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Information card for entry 4503164
Preview
Coordinates | 4503164.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C12 H10 Cu N2 O10 P2 |
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Calculated formula | C12 H10 Cu N2 O10 P2 |
SMILES | c12cc(cc[n]1[Cu]1([n]3c(cc(cc3)C(=O)O)P(=O)(O1)O)OP2(=O)O)C(=O)O |
Title of publication | Copper Phosphonates based on 2-Phosphonic-isonicotinate: Structures and Magnetic Properties |
Authors of publication | Yang, Yi-Fan; Ma, Yun-Sheng; Guo, Li-Rong; Zheng, Li-Min |
Journal of publication | Crystal Growth & Design |
Year of publication | 2008 |
Journal volume | 8 |
Journal issue | 4 |
Pages of publication | 1213 |
a | 19.039 ± 0.003 Å |
b | 7.1853 ± 0.0013 Å |
c | 12.355 ± 0.002 Å |
α | 90° |
β | 116.666 ± 0.003° |
γ | 90° |
Cell volume | 1510.4 ± 0.4 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 298 ± 2 K |
Number of distinct elements | 6 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0461 |
Residual factor for significantly intense reflections | 0.0405 |
Weighted residual factors for significantly intense reflections | 0.087 |
Weighted residual factors for all reflections included in the refinement | 0.0896 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.039 |
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/4503164.html
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