Information card for entry 7033217

Structure parameters

• Formula: C18 H20 Mo2 N2 O9 S3
• Calculated formula: C18 H20 Mo2 N2 O9 S3
• Title of publication: Thiohydrazide complexes of molybdenum and their relevance to reduction of dinitrogen to ammonia.
• Authors of publication: Sengupta, Dolan; Gangopadhyay, Snigdha; Drew, Michael G. B.; Gangopadhyay, Pijush Kanti
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 3
• Pages of publication: 1323 - 1331
• a: 7.2719 ± 0.0004 Å
• b: 8.8902 ± 0.0007 Å
• c: 10.5788 ± 0.0007 Å
• α: 68.497 ± 0.007°
• β: 87.429 ± 0.005°
• γ: 71.028 ± 0.006°
• Cell volume: 599.59 ± 0.08 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 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: 0.036
• Residual factor for significantly intense reflections: 0.0316
• Weighted residual factors for significantly intense reflections: 0.0809
• Weighted residual factors for all reflections included in the refinement: 0.0832
• Goodness-of-fit parameter for all reflections included in the refinement: 0.762
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No