Information card for entry 4321531

Structure parameters

• Formula: C44 H36 F12 N12 O12 S4 Zn2
• Calculated formula: C44 H36 F12 N12 O12 S4 Zn2
• Title of publication: Synthesis and Structure of Dimeric [(cis-Py3Im)M]2 Complexes [M = Ni, Cu, Zn; (cis-Py3Im) = cis-2,4,5-Tri(2-pyridyl)imidazoline]
• Authors of publication: Miguel Parra-Hake; Martin L. Larter; Peter Gantzel; Gerardo Aguirre; Fernando Ortega; Ratnasamy Somanathan; Patrick J. Walsh
• Journal of publication: Inorganic Chemistry
• Year of publication: 2000
• Journal volume: 39
• Pages of publication: 5400 - 5403
• a: 12.208 ± 0.011 Å
• b: 37.67 ± 0.022 Å
• c: 13.308 ± 0.012 Å
• α: 90°
• β: 113.03 ± 0.06°
• γ: 90°
• Cell volume: 5632 ± 8 ų
• Cell temperature: 189 ± 2 K
• Ambient diffraction temperature: 189 K
• Number of distinct elements: 7
• 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: 0.0763
• Residual factor for significantly intense reflections: 0.0541
• Weighted residual factors for all reflections: 0.1387
• Weighted residual factors for significantly intense reflections: 0.1132
• Goodness-of-fit parameter for all reflections: 1.109
• Goodness-of-fit parameter for significantly intense reflections: 1.116
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No