Information card for entry 4114572

Structure parameters

• Formula: C18 H21 N3 O30 V12
• Calculated formula: C18 H21 N3 O30 V12
• Title of publication: Strong Electron-Acceptor Methylviologen Dications Confined in a 2D Inorganic Host: Synthesis, Structural Characterization, Charge Transport and Electrochemical Properties of (MV)0.25V2O5
• Authors of publication: Anima Bose; Pingang He; Charles Liu; Brett D. Ellman; Robert J. Twieg; Songping D. Huang
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2002
• Journal volume: 124
• Pages of publication: 4 - 5
• a: 11.5683 ± 0.0014 Å
• b: 13.4244 ± 0.0017 Å
• c: 14.2656 ± 0.0018 Å
• α: 67.015 ± 0.002°
• β: 72.957 ± 0.002°
• γ: 84.403 ± 0.002°
• Cell volume: 1949.6 ± 0.4 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: 0.2334
• Residual factor for significantly intense reflections: 0.0877
• Weighted residual factors for significantly intense reflections: 0.1802
• Weighted residual factors for all reflections included in the refinement: 0.2446
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No