Information card for entry 7215780

Structure parameters

• Formula: C10 H32 Ag2 I6 N4 O2
• Calculated formula: C10 H32 Ag2 I6 N4 O2
• SMILES: C1C[NH+](CC[NH2+]1)C.I[Ag]1(I)[I][Ag](I)([I]1)I.O.C1C[NH+](CC[NH2+]1)C.O
• Title of publication: Solvent-cooperatively directed iodoargentate hybrids: Structures and optical properties
• Authors of publication: Yu, Tanlai; Shen, Junju; Fu, Yangbo; Fu, Yunlong
• Journal of publication: CrystEngComm
• Year of publication: 2014
• Journal volume: 16
• Journal issue: 24
• Pages of publication: 5280
• a: 7.7685 ± 0.0003 Å
• b: 14.0322 ± 0.0004 Å
• c: 12.8393 ± 0.0004 Å
• α: 90°
• β: 94.638 ± 0.003°
• γ: 90°
• Cell volume: 1395.02 ± 0.08 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0373
• Residual factor for significantly intense reflections: 0.0292
• Weighted residual factors for significantly intense reflections: 0.0597
• Weighted residual factors for all reflections included in the refinement: 0.0638
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No