Information card for entry 2215372

Structure parameters

• Chemical name: (2,2'-Biquinoline)tetracarbonylmolybdenum(0)
• Formula: C22 H12 Mo N2 O4
• Calculated formula: C22 H12 Mo N2 O4
• SMILES: [Mo]1(C#[O])(C#[O])(C#[O])(C#[O])[n]2c3ccccc3ccc2c2[n]1c1c(cc2)cccc1
• Title of publication: (2,2'-Biquinoline)tetracarbonylmolybdenum(0)
• Authors of publication: Muir, Kathleen J.; McQuillan, Geoffrey P.; Harrison, William T. A.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 10
• Pages of publication: m2452 - m2452
• a: 7.7365 ± 0.0004 Å
• b: 9.8294 ± 0.0005 Å
• c: 12.806 ± 0.0006 Å
• α: 93.512 ± 0.001°
• β: 94.215 ± 0.001°
• γ: 109.394 ± 0.001°
• Cell volume: 912.29 ± 0.08 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 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 all reflections: 0.0414
• Residual factor for significantly intense reflections: 0.0312
• Weighted residual factors for significantly intense reflections: 0.0753
• Weighted residual factors for all reflections included in the refinement: 0.0789
• Goodness-of-fit parameter for all reflections included in the refinement: 0.989
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes