Information card for entry 7114820

Structure parameters

• Formula: C10 H8 Co N6 O4 S2
• Calculated formula: C10 H8 Co N6 O4 S2
• Title of publication: Pyrazine dioxide bridged two-dimensional antiferromagnets [M(NCS)2(pzdo)2] (M = Mn, Co; pzdo = pyrazine dioxide)Electronic supplementary information (ESI) available: Fig. S1: two types of coordination mode for pzdo. Fig. S2: perspective view of compound 2 along the [010] direction. See http://www.rsc.org/suppdata/cc/b1/b107334f/
• Authors of publication: Sun, Hao-Ling; Ma, Bao-Qing; Gao, Song; Su, Gang
• Journal of publication: Chemical Communications
• Year of publication: 2001
• Journal issue: 24
• Pages of publication: 2586
• a: 6.8922 ± 0.0014 Å
• b: 7.1528 ± 0.0014 Å
• c: 8.1074 ± 0.0016 Å
• α: 82.49 ± 0.03°
• β: 67.26 ± 0.03°
• γ: 74.06 ± 0.03°
• Cell volume: 354.31 ± 0.15 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0417
• Residual factor for significantly intense reflections: 0.0306
• Weighted residual factors for significantly intense reflections: 0.0722
• Weighted residual factors for all reflections included in the refinement: 0.0763
• Goodness-of-fit parameter for all reflections included in the refinement: 0.999
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No