Information card for entry 7238651

Structure parameters

• Formula: C23 H18 Cr O3 S2
• Calculated formula: C23 H18 Cr O3 S2
• Title of publication: Lithiation of η6-fluorobenzenetricarbonylchromium(0) and reaction with dialkyl disulfides: synthesis of η6-1,2-bis- and 1,2,3-tris-alkylsulfanylbenzenetricarbonylchromium(0) complexes
• Authors of publication: Woolford, Helen; Elsegood, Mark R. J.; Weaver, George W.
• Journal of publication: RSC Advances
• Year of publication: 2012
• Journal volume: 2
• Journal issue: 14
• Pages of publication: 6049
• a: 9.013 ± 0.0009 Å
• b: 10.2094 ± 0.001 Å
• c: 12.8603 ± 0.0013 Å
• α: 106.757 ± 0.0015°
• β: 99.0147 ± 0.0016°
• γ: 109.56 ± 0.0015°
• Cell volume: 1024.83 ± 0.18 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0406
• Residual factor for significantly intense reflections: 0.0315
• Weighted residual factors for significantly intense reflections: 0.0764
• Weighted residual factors for all reflections included in the refinement: 0.0819
• Goodness-of-fit parameter for all reflections included in the refinement: 1.064
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No