Information card for entry 7046869

Structure parameters

• Formula: C102 H111 F30 Mn2 N27 O0 P5 Ru
• Calculated formula: C102 H111 F30 Mn2 N27 P5 Ru
• Title of publication: Redox-induced switch between luminescence and magnetism in a trinuclear cyanide-bridged compound.
• Authors of publication: Zhu, Xiao-Quan; Su, Shao-Dong; Wen, Yue-Hong; Zhang, Lin-Tao; Yang, Yu-Ying; Wu, Xin-Tao; Sheng, Tian-Lu
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 30
• Pages of publication: 9985 - 9988
• a: 12.359 ± 0.002 Å
• b: 15.942 ± 0.002 Å
• c: 16.259 ± 0.002 Å
• α: 65.653 ± 0.003°
• β: 88.991 ± 0.005°
• γ: 86.804 ± 0.005°
• Cell volume: 2914 ± 0.7 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0486
• Residual factor for significantly intense reflections: 0.0412
• Weighted residual factors for significantly intense reflections: 0.1027
• Weighted residual factors for all reflections included in the refinement: 0.1088
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No