Information card for entry 7029521

Structure parameters

• Formula: C18 H24 Mo2 N4 O6 S4
• Calculated formula: C18 H24 Mo2 N4 O6 S4
• Title of publication: Electronic tuning of Mo2(thioamidate)4 complexes through π-system substituents and cis/trans isomerism.
• Authors of publication: Dolinar, Brian S.; Berry, John F.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 16
• Pages of publication: 6165 - 6176
• a: 8.99 ± 0.003 Å
• b: 14.717 ± 0.007 Å
• c: 10.048 ± 0.004 Å
• α: 89.646 ± 0.017°
• β: 112.528 ± 0.013°
• γ: 88.73 ± 0.02°
• Cell volume: 1227.5 ± 0.9 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.074
• Residual factor for significantly intense reflections: 0.0516
• Weighted residual factors for significantly intense reflections: 0.1176
• Weighted residual factors for all reflections included in the refinement: 0.1269
• Goodness-of-fit parameter for all reflections included in the refinement: 0.978
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No