Information card for entry 4074669

Structure parameters

• Chemical name: [Ti2(mu-S)2(C5Me5)2{PhC(NSiMe3)2}2]
• Formula: C46 H76 N4 S2 Si4 Ti2
• Calculated formula: C46 H76 N4 S2 Si4 Ti2
• Title of publication: Reactions of Cyclopentadienyl-Amidinate Titanium Imido Compounds with CS2, COS, Isocyanates, and Other Unsaturated Organic Compounds
• Authors of publication: Guiducci, Aldo E.; Boyd, Catherine L.; Mountford, Philip
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 5
• Pages of publication: 1167 - 1187
• a: 20.5239 ± 0.0008 Å
• b: 14.2637 ± 0.0007 Å
• c: 10.5071 ± 0.0004 Å
• α: 90°
• β: 104.031 ± 0.003°
• γ: 90°
• Cell volume: 2984.1 ± 0.2 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 6
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for significantly intense reflections: 0.0744
• Weighted residual factors for significantly intense reflections: 0.09
• Goodness-of-fit parameter for significantly intense reflections: 0.9111
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No