Information card for entry 7047735

Structure parameters

• Formula: C8 H16 Cl2 Mn N2 O2 S2
• Calculated formula: C8 H16 Cl2 Mn N2 O2 S2
• Title of publication: Photoinduced electron transfer and remarkable enhancement of magnetic susceptibility in bridging pyrazine complexes.
• Authors of publication: Xia, Bin; Zhou, Yu; Wang, Qing-Lun; Xu, Xiu-Fang; Tong, Yu-Zhang; Bu, Xian-He; Li, Jian-Rong
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 44
• Pages of publication: 15888 - 15896
• a: 6.7776 ± 0.0002 Å
• b: 6.7893 ± 0.0002 Å
• c: 8.8775 ± 0.0003 Å
• α: 86.438 ± 0.002°
• β: 84.513 ± 0.003°
• γ: 65.677 ± 0.003°
• Cell volume: 370.42 ± 0.02 ų
• Cell temperature: 120 ± 0.1 K
• Ambient diffraction temperature: 120 ± 0.1 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0228
• Residual factor for significantly intense reflections: 0.0228
• Weighted residual factors for significantly intense reflections: 0.0602
• Weighted residual factors for all reflections included in the refinement: 0.0602
• Goodness-of-fit parameter for all reflections included in the refinement: 1.078
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No