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Information card for entry 1575038
Preview
Coordinates | 1575038.cif |
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Original paper (by DOI) | HTML |
Formula | C12 H16 Cu N2 O8 |
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Calculated formula | C12 H16 Cu N2 O8 |
Title of publication | Simultaneous electron and proton conduction in a stable metal organic material with highly selective electrocatalytic oxygen reduction reaction to water |
Authors of publication | Saha, Rajat; Sharma, Amitosh; Siddiqui, Anjila I.; Benmansour, Samia; Ortega-Castro, Joaquín; Frontera, Antonio; Mondal, Biswajit; Lah, Myoung Soo; Gómez García, Carlos J. |
Journal of publication | Chemical Science |
Year of publication | 2025 |
Journal volume | 16 |
Journal issue | 21 |
Pages of publication | 9501 - 9508 |
a | 6.3123 ± 0.0003 Å |
b | 6.8085 ± 0.0003 Å |
c | 9.1809 ± 0.0004 Å |
α | 98.952 ± 0.004° |
β | 105.115 ± 0.004° |
γ | 108.659 ± 0.004° |
Cell volume | 348.36 ± 0.03 Å3 |
Cell temperature | 119.99 ± 0.1 K |
Ambient diffraction temperature | 119.99 ± 0.1 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0316 |
Residual factor for significantly intense reflections | 0.0283 |
Weighted residual factors for significantly intense reflections | 0.0711 |
Weighted residual factors for all reflections included in the refinement | 0.0784 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.112 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
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300334 (current) | 2025-07-04 | cif/ Adding structures of 1575038 via cif-deposit CGI script. |
1575038.cif |
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