Information card for entry 4071448

Structure parameters

• Chemical name: (Ethoxy-(η^6^-tricarbonylchromium-benzo[b]thien-2-yl)-methylidene)- (pentacarbonyl)-chromium
• Formula: C19 H10 Cr2 O9 S
• Calculated formula: C19 H10 Cr2 O9 S
• Title of publication: Steric and Electronic Effects of Metal-Containing Substituents in Fischer Carbene Complexes of Chromium
• Authors of publication: Bezuidenhout, Daniela I.; van der Watt, Elisia; Liles, David C.; Landman, Marilé; Lotz, Simon
• Journal of publication: Organometallics
• Year of publication: 2008
• Journal volume: 27
• Journal issue: 11
• Pages of publication: 2447
• a: 8.3523 ± 0.0011 Å
• b: 10.7547 ± 0.0015 Å
• c: 13.0118 ± 0.0017 Å
• α: 109.519 ± 0.002°
• β: 108.371 ± 0.002°
• γ: 95.519 ± 0.002°
• Cell volume: 1018.6 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0411
• Residual factor for significantly intense reflections: 0.037
• Weighted residual factors for significantly intense reflections: 0.0992
• Weighted residual factors for all reflections included in the refinement: 0.104
• Goodness-of-fit parameter for all reflections included in the refinement: 1.096
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No