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Information card for entry 1570271
Preview
Coordinates | 1570271.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C38 H42 Cl2 Cu2 N6 O15 |
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Calculated formula | C38 H42 Cl2 Cu2 N6 O15 |
Title of publication | Deciphering the anisotropic energy harvesting responses of an above room temperature molecular ferroelectric copper(II) complex single crystal. |
Authors of publication | Haldar, Rajashi; Kumar, Ajay; Mandal, Dipankar; Shanmugam, Maheswaran |
Journal of publication | Materials horizons |
Year of publication | 2024 |
Journal volume | 11 |
Journal issue | 2 |
Pages of publication | 454 - 459 |
a | 9.3868 ± 0.0002 Å |
b | 15.5499 ± 0.0003 Å |
c | 14.4461 ± 0.0002 Å |
α | 90° |
β | 93.944 ± 0.002° |
γ | 90° |
Cell volume | 2103.61 ± 0.07 Å3 |
Cell temperature | 150 ± 0.1 K |
Ambient diffraction temperature | 150 ± 0.1 K |
Number of distinct elements | 6 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0325 |
Residual factor for significantly intense reflections | 0.0285 |
Weighted residual factors for significantly intense reflections | 0.0609 |
Weighted residual factors for all reflections included in the refinement | 0.0629 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.029 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/1570271.html
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