Information card for entry 7030360

Structure parameters

• Formula: C34.25 H36.5 Cl0.5 F15 Mo N O2
• Calculated formula: C34.25 H36.5 Cl0.5 F15 Mo N O2
• Title of publication: Mononuclear anionic AO2X3 compounds with non-VSEPR structure.
• Authors of publication: García-Monforte, M Angeles; Baya, Miguel; Betoré, M Pilar; Martín, Antonio; Menjón, Babil
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 20
• Pages of publication: 7615 - 7621
• a: 11.1922 ± 0.0003 Å
• b: 12.953 ± 0.0004 Å
• c: 13.1007 ± 0.0005 Å
• α: 79.063 ± 0.003°
• β: 84.902 ± 0.003°
• γ: 83.183 ± 0.003°
• Cell volume: 1847.27 ± 0.11 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1155
• Residual factor for significantly intense reflections: 0.052
• Weighted residual factors for significantly intense reflections: 0.0742
• Weighted residual factors for all reflections included in the refinement: 0.0812
• Goodness-of-fit parameter for all reflections included in the refinement: 0.875
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No