Information card for entry 7016082

Structure parameters

• Common name: ((Chloro-bis(eta$5!-pentadienyl)-titanium-oxy)-(eta$6!- tricarbonylchromium-benzo(b)thien-2-yl)-methylidene)-(pentacarbonyl)- tungsten dichloromethane solvate
• Chemical name: ((Chloro-bis(η^5^-pentadienyl)-titanium-oxy)-(η^6^-tricarbonylchromium- benzo[b]thien-2-yl)-methylidene)-(pentacarbonyl)-tungsten dichloromethane solvate
• Formula: C28 H17 Cl3 Cr O9 S Ti W
• Calculated formula: C28 H17 Cl3 Cr O9 S Ti W
• Title of publication: Multimetal Fischer carbene complexes of Group VI transition metals: synthesis, structure and substituent effect investigation.
• Authors of publication: Bezuidenhout, Daniela I.; Barnard, Werner; van der Westhuizen, Belinda; van der Watt, Elisia; Liles, David C.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 25
• Pages of publication: 6711 - 6721
• a: 11.228 ± 0.0005 Å
• b: 12.2398 ± 0.0005 Å
• c: 23.9446 ± 0.0011 Å
• α: 90°
• β: 101.298 ± 0.001°
• γ: 90°
• Cell volume: 3226.9 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0435
• Residual factor for significantly intense reflections: 0.0307
• Weighted residual factors for significantly intense reflections: 0.0773
• Weighted residual factors for all reflections included in the refinement: 0.0871
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No