Information card for entry 4309240

Structure parameters

• Formula: C35.7 H37.55 Cr3 N10.85 O6 S3
• Calculated formula: C35.7 H37.55 Cr3 N10.85 O6 S3
• Title of publication: Heterocyclic Thionates as a New Class of Bridging Ligands in Oxo-Centered Triangular Cyclopentadienylchromium(III) Complexes
• Authors of publication: Victor Wee Lin Ng; Seah Ling Kuan; Weng Kee Leong; Lip Lin Koh; Geok Kheng Tan; Lai Yoong Goh; Richard D. Webster
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 5229 - 5240
• a: 11.634 ± 0.002 Å
• b: 13.358 ± 0.002 Å
• c: 15.74 ± 0.003 Å
• α: 109.677 ± 0.003°
• β: 109.671 ± 0.003°
• γ: 92.603 ± 0.003°
• Cell volume: 2133.8 ± 0.6 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 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: 0.0707
• Residual factor for significantly intense reflections: 0.0543
• Weighted residual factors for significantly intense reflections: 0.1445
• Weighted residual factors for all reflections included in the refinement: 0.1538
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No