Information card for entry 7223488

Structure parameters

• Formula: C72 H48 Ag3 I7 Mn2 N12
• Calculated formula: C72 H48 Ag3 I7 Mn2 N12
• SMILES: c1c2ccc[n]3c2c2c(ccc[n]2[Mn]243([n]3cccc5ccc6ccc[n]2c6c35)[n]2cccc3ccc5ccc[n]4c5c23)c1.[I]([Ag](I)I)([Ag](I)I)[Ag](I)I.c1ccc2ccc3ccc[n]4c3c2[n]1[Mn]124([n]3cccc4ccc5ccc[n]1c5c34)[n]1cccc3ccc4ccc[n]2c4c13
• Title of publication: Syntheses, crystal structures and photocatalytic properties of four hybrid iodoargentates with zero- and two-dimensional structures
• Authors of publication: Lei, Xiao-Wu; Yue, Cheng-Yang; Feng, Li-Juan; Han, Yong-Fang; Meng, Rong-Rong; Yang, Jiang-Tao; Ding, Hao; Gao, Chuan-Sheng; Wang, Chun-Yan
• Journal of publication: CrystEngComm
• Year of publication: 2016
• Journal volume: 18
• Journal issue: 3
• Pages of publication: 427
• a: 15.1789 ± 0.0004 Å
• b: 15.1789 ± 0.0004 Å
• c: 58.192 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 11611.1 ± 0.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 167
• Hermann-Mauguin space group symbol: R -3 c :H
• Hall space group symbol: -R 3 2"c
• Residual factor for all reflections: 0.0483
• Residual factor for significantly intense reflections: 0.0435
• Weighted residual factors for significantly intense reflections: 0.1445
• Weighted residual factors for all reflections included in the refinement: 0.1493
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No