Information card for entry 3000223

Structure parameters

• Formula: C12 H25 N10 O9.5 S Zn
• Calculated formula: C12 H20 N10 O9.5 S Zn
• Title of publication: Anti-diabetic and anti-parasitic properties of a family of luminescent zinc coordination compounds based on the 7-amino-5-methyl-1,2,4-triazolo[1,5-a]pyrimidine ligand
• Authors of publication: Gines M. Esteban-Parra; Eider San Sebastián; Javier Cepeda; Cristina Sánchez-González; Lorenzo Rivas; Juan Llopis; Pilar Aranda; Miguel Quirós; Antonio Rodríguez-Diéguez
• Journal of publication: Journal of Inorganic Biochemistry
• Year of publication: 2020
• Journal volume: 212
• Pages of publication: 111235
• a: 8.0644 ± 0.0006 Å
• b: 11.9048 ± 0.001 Å
• c: 12.3145 ± 0.001 Å
• α: 71.664 ± 0.003°
• β: 74.549 ± 0.003°
• γ: 76.161 ± 0.003°
• Cell volume: 1065.96 ± 0.15 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0467
• Residual factor for significantly intense reflections: 0.039
• Weighted residual factors for significantly intense reflections: 0.0962
• Weighted residual factors for all reflections included in the refinement: 0.1021
• Goodness-of-fit parameter for all reflections included in the refinement: 0.935
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes