Information card for entry 1511774

Structure parameters

• Chemical name: Diaqua-bis(4,5,6,7-tetrahydro-5,7-dioxo(1,2,4)triazolo(1,5-a)pyridimine) -manganese
• Formula: C10 H10 Mn N8 O6
• Calculated formula: C10 H10 Mn N8 O6
• Title of publication: First Tansition Row Metal Complexes with 4,5,6,7-Tetrahydro-5,7-dioxo-[1,2,4]triazolo-[1,5-a]pyrimidine
• Authors of publication: Sonia Orihuela; M. Purificación Sánchez; Miguel Quirós; Daniel Martín; René Faure
• Journal of publication: Polyhedron
• Year of publication: 1998
• Journal volume: 17
• Pages of publication: 2477 - 2481
• a: 4.984 ± 0.001 Å
• b: 8.325 ± 0.002 Å
• c: 9.227 ± 0.002 Å
• α: 74.15 ± 0.02°
• β: 89.54 ± 0.01°
• γ: 76.44 ± 0.02°
• Cell volume: 357.38 ± 0.14 ų
• Ambient diffraction temperature: 298 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 significantly intense reflections: 0.037
• Weighted residual factors for all reflections included in the refinement: 0.067
• Goodness-of-fit parameter for all reflections included in the refinement: 1.32
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No