Information card for entry 7247417

Structure parameters

• Formula: C8 H18 Cu N8 O14
• Calculated formula: C8 H18 Cu N8 O14
• Title of publication: A new approach to study semi-coordination using two 2-methyl-5-nitroimidazole copper(ii) complexes of biological interest as a model system
• Authors of publication: Fachini, Lucas G.; Baptistella, Gabriel B.; Postal, Kahoana; Santana, Francielli S.; de Souza, Emanuel M.; Ribeiro, Ronny R.; Nunes, Giovana G.; Sá, Eduardo L.
• Journal of publication: RSC Advances
• Year of publication: 2023
• Journal volume: 13
• Journal issue: 40
• Pages of publication: 27997 - 28007
• a: 6.714 ± 0.002 Å
• b: 10.504 ± 0.004 Å
• c: 14.095 ± 0.005 Å
• α: 90°
• β: 103.104 ± 0.011°
• γ: 90°
• Cell volume: 968.1 ± 0.6 ų
• Cell temperature: 201 ± 2 K
• Ambient diffraction temperature: 201 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0282
• Residual factor for significantly intense reflections: 0.0242
• Weighted residual factors for significantly intense reflections: 0.0668
• Weighted residual factors for all reflections included in the refinement: 0.0685
• Goodness-of-fit parameter for all reflections included in the refinement: 1.082
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No