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Information card for entry 4003154
Preview
Coordinates | 4003154.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C32 H30 Cu N10 O8 P2 |
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Calculated formula | C32 H30 Cu N10 O8 P2 |
SMILES | [Cu]1234([O]=P(c5ccccc5)(Nc5cccc[n]15)Nc1cccc[n]31)[O]=P(c1ccccc1)(Nc1cccc[n]21)Nc1cccc[n]41.N(=O)(=O)[O-].N(=O)(=O)[O-] |
Title of publication | Potentially Ferroelectric {CuIIL2}n Based Two-Dimensional Framework Exhibiting High Polarization and Guest-Assisted Dielectric Anomaly |
Authors of publication | Srivastava, Anant Kumar; Divya, Pillutla; Praveenkumar, B.; Boomishankar, Ramamoorthy |
Journal of publication | Chemistry of Materials |
Year of publication | 2015 |
Journal volume | 27 |
Journal issue | 15 |
Pages of publication | 5222 |
a | 23.781 ± 0.005 Å |
b | 23.781 ± 0.005 Å |
c | 11.844 ± 0.003 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 6698 ± 3 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 6 |
Space group number | 88 |
Hermann-Mauguin space group symbol | I 41/a :2 |
Hall space group symbol | -I 4ad |
Residual factor for all reflections | 0.0912 |
Residual factor for significantly intense reflections | 0.0436 |
Weighted residual factors for significantly intense reflections | 0.085 |
Weighted residual factors for all reflections included in the refinement | 0.1003 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.005 |
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/4003154.html
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