Information card for entry 7060792

Structure parameters

• Formula: C13 H17 Cl N5 O2 Re Se2
• Calculated formula: C13 H17 Cl N5 O2 Re Se2
• Title of publication: Coordination compounds containing 2-pyridylselenium ligands: synthesis, structural characterization, and antibacterial evaluation
• Authors of publication: Cervo, Rodrigo; Lopes, Thaísa R. R.; de Vasconcelos, Adriana R.; Cargnelutti, Juliana F.; Schumacher, Ricardo F.; Tirloni, Bárbara; dos Santos, Sailer S.; Abram, Ulrich; Lang, Ernesto S.; Cargnelutti, Roberta
• Journal of publication: New Journal of Chemistry
• Year of publication: 2021
• Journal volume: 45
• Journal issue: 29
• Pages of publication: 12863 - 12870
• a: 7.0855 ± 0.0016 Å
• b: 16.597 ± 0.005 Å
• c: 31.064 ± 0.009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3653.1 ± 1.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0241
• Residual factor for significantly intense reflections: 0.0189
• Weighted residual factors for significantly intense reflections: 0.0375
• Weighted residual factors for all reflections included in the refinement: 0.0401
• Goodness-of-fit parameter for all reflections included in the refinement: 1.169
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No