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Information card for entry 7062689
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Coordinates | 7062689.cif |
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Original paper (by DOI) | HTML |
Formula | C22 H26 N2 O7 U |
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Calculated formula | C22 H26 N2 O7 U |
Title of publication | Uranyl N2O2-Schiff base complex as co-catalyst in ethanol electro-oxidation: synthesis, crystallographic, spectroscopic, electrochemical, and DFT characterization, and catalytic investigation |
Authors of publication | Barbosa, Elizomar Medeiros; Soares, Kaique Souza; Cruz, Julianna Ferreira; Doring, Thiago Henrique; de França, Igor Vinicius; Mello, Lucas dos S.; Nagurniak, Glaucio R.; Parreira, Renato L. T.; Alvarenga, Meiry Edivirges; Martins, Felipe Terra; Dockal, Edward Ralph; Souza, Elson Almeida; Maia, Paulo José Sousa; da Cruz, José Wilmo |
Journal of publication | New Journal of Chemistry |
Year of publication | 2023 |
Journal volume | 47 |
Journal issue | 37 |
Pages of publication | 17393 - 17405 |
a | 10.7112 ± 0.0009 Å |
b | 9.2411 ± 0.0008 Å |
c | 23.046 ± 0.002 Å |
α | 90° |
β | 97.428 ± 0.003° |
γ | 90° |
Cell volume | 2262 ± 0.3 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 298 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0491 |
Residual factor for significantly intense reflections | 0.0348 |
Weighted residual factors for significantly intense reflections | 0.064 |
Weighted residual factors for all reflections included in the refinement | 0.0666 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.074 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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