Information card for entry 7043590

Structure parameters

• Formula: C53 H41 N2 O12 Rh S32
• Calculated formula: C53 H40 N2 O12 Rh S32
• Title of publication: Molecular conductors from bis(ethylenedithio)tetrathiafulvalene with tris(oxalato)rhodate
• Authors of publication: Martin, Lee; Morritt, Alexander L.; Lopez, Jordan R.; Nakazawa, Yasuhiro; Akutsu, Hiroki; Imajo, Shusaku; Ihara, Yoshihiko; Zhang, Bin; Zhang, Yan; Guo, Yanjun
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 10.43833 ± 0.00016 Å
• b: 19.6739 ± 0.0003 Å
• c: 35.9215 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 7376.9 ± 0.2 ų
• Cell temperature: 292 K
• Ambient diffraction temperature: 292 K
• Number of distinct elements: 6
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0596
• Residual factor for significantly intense reflections: 0.058
• Weighted residual factors for all reflections: 0.128
• Weighted residual factors for significantly intense reflections: 0.1272
• Weighted residual factors for all reflections included in the refinement: 0.128
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0478
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No