Information card for entry 7043095

Structure parameters

• Formula: C49 H45 Mn2 N3 O11
• Calculated formula: C49 H45 Mn2 N3 O11
• Title of publication: The Photocurrent Response in the Perovskite Device Based on Coordination Polymer: Structure, Topology, Band Gap and Matched Energy Level
• Authors of publication: Luo, Hai Qiang; Xin, Xiao Han; Zhang, Pan; Yan, Zhi Shuo; Zhou, Qingfeng; Gong, Yun; Lin, Jianhua
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 11.3946 ± 0.0009 Å
• b: 28.293 ± 0.003 Å
• c: 15.2096 ± 0.0014 Å
• α: 90°
• β: 102.511 ± 0.002°
• γ: 90°
• Cell volume: 4787 ± 0.8 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1093
• Residual factor for significantly intense reflections: 0.0531
• Weighted residual factors for significantly intense reflections: 0.1033
• Weighted residual factors for all reflections included in the refinement: 0.1174
• Goodness-of-fit parameter for all reflections included in the refinement: 0.972
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No