Information card for entry 7701954

Structure parameters

• Formula: C28 H22 Mn N O8
• Calculated formula: C28 H22 Mn N O8
• Title of publication: A series of host-guest coordination polymers containing viologens: syntheses, crystal Structures, thermo/photochromism and influence factors of the thermo/photochromic behaviors
• Authors of publication: Kan, Wei-Qiu; He, Yuan-Chun; Wen, Shizheng; Zhao, Pu Su
• Journal of publication: Dalton Transactions
• Year of publication: 2019
• a: 9.6912 ± 0.0005 Å
• b: 10.6438 ± 0.0005 Å
• c: 12.065 ± 0.0005 Å
• α: 72.106 ± 0.002°
• β: 83.744 ± 0.002°
• γ: 81.562 ± 0.002°
• Cell volume: 1168.8 ± 0.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0605
• Residual factor for significantly intense reflections: 0.0429
• Weighted residual factors for significantly intense reflections: 0.0921
• Weighted residual factors for all reflections included in the refinement: 0.1006
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No