Information card for entry 4317974

Structure parameters

• Chemical name: tetrakis(N-pyridylpropionamide-N,N')dimolybdenum(II,II), tetrahydrofuran solvate
• Formula: C40 H52 Mo2 N8 O6
• Calculated formula: C40 H36 Mo2 N8 O6.01
• Title of publication: The Lengths of Molybdenum to Molybdenum Quadruple Bonds: Correlations, Explanations, and Corrections
• Authors of publication: F. Albert Cotton; Lee M. Daniels; Elizabeth A. Hillard; Carlos A. Murillo
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 2466 - 2470
• a: 11.0621 ± 0.001 Å
• b: 26.886 ± 0.002 Å
• c: 13.7039 ± 0.0012 Å
• α: 90°
• β: 94.311 ± 0.002°
• γ: 90°
• Cell volume: 4064.2 ± 0.6 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/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.098
• Residual factor for significantly intense reflections: 0.0618
• Weighted residual factors for significantly intense reflections: 0.1346
• Weighted residual factors for all reflections included in the refinement: 0.1514
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No