Information card for entry 4113787

Structure parameters

• Formula: C24 H14 Ag2 N4 O2
• Calculated formula: C24 H14 Ag2 N4 O2
• SMILES: [Ag]123[n]4c(ccc5ccc6ccc[n]1c6c45)O[Ag]13[n]3c(ccc4ccc5ccc[n]1c5c34)O2
• Title of publication: A Novel, Highly Electrical Conducting, Single-Component Molecular Material: [Ag2(ophen)2] (Hophen = 1H-[1,10]phenanthrolin-2-one)
• Authors of publication: Shao-Liang Zheng; Jie-Peng Zhang; Wing-Tak Wong; Xiao-Ming Chen
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2003
• Journal volume: 125
• Pages of publication: 6882 - 6883
• a: 10.248 ± 0.0015 Å
• b: 6.4267 ± 0.0009 Å
• c: 14.835 ± 0.002 Å
• α: 90°
• β: 95.702 ± 0.003°
• γ: 90°
• Cell volume: 972.2 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0454
• Residual factor for significantly intense reflections: 0.032
• Weighted residual factors for significantly intense reflections: 0.0827
• Weighted residual factors for all reflections included in the refinement: 0.0874
• Goodness-of-fit parameter for all reflections included in the refinement: 0.991
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No