Information card for entry 2201201

Structure parameters

• Chemical name: μ-terephthalate-bis[tris(μ-N,N'-di-p-anisylformamidinate)dimolybdenum(II)] hexane disolvate
• Formula: C110 H122 Mo4 N12 O16
• Calculated formula: C110 H94 Mo4 N12 O16
• Title of publication: A molecular pair having two quadruply bonded dimolybdenum units linked by a terephthalate dianion
• Authors of publication: Cotton, F. Albert; Donahue, James P.; Lin, Chun; Murillo, Carlos A.; Rockwell, Jeffrey
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 6
• Pages of publication: m298 - m300
• a: 14.6579 ± 0.0015 Å
• b: 18.163 ± 0.0019 Å
• c: 19.268 ± 0.002 Å
• α: 90°
• β: 94.621 ± 0.002°
• γ: 90°
• Cell volume: 5113.1 ± 0.9 ų
• Cell temperature: 213 ± 2 K
• Ambient diffraction temperature: 213 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1118
• Residual factor for significantly intense reflections: 0.057
• Weighted residual factors for significantly intense reflections: 0.133
• Weighted residual factors for all reflections included in the refinement: 0.166
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes