Information card for entry 4321088

Structure parameters

• Chemical name: Ag(dmb)2(TCNQ) 1.5(TCNQ)
• Formula: C54 H46 Ag N14
• Calculated formula: C54 H46 Ag N14
• Title of publication: Preparation and Characterization of {[M(dmb)2]TCNQ.xTCNQ° }n Polymers (M = Cu,Ag; dmb = 1,8-Diisocyano-p-menthane; x = 0, 0.5, 1.0, 1.5; TCNQ = 7,7,8,8-Tetracyano-p-quinodimethane) and Design of New Semi- and Photoconducting Organometallic Materials
• Authors of publication: Daniel Fortin; Marc Drouin; Pierre D. Harvey
• Journal of publication: Inorganic Chemistry
• Year of publication: 2000
• Journal volume: 39
• Pages of publication: 2758 - 2769
• a: 25.83 ± 0.011 Å
• b: 9.68 ± 0.002 Å
• c: 42.183 ± 0.019 Å
• α: 90°
• β: 104.87 ± 0.04°
• γ: 90°
• Cell volume: 10194 ± 7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1642
• Residual factor for significantly intense reflections: 0.0701
• Weighted residual factors for significantly intense reflections: 0.1723
• Weighted residual factors for all reflections included in the refinement: 0.2133
• Goodness-of-fit parameter for all reflections included in the refinement: 0.949
• Diffraction radiation wavelength: 1.5406 Å
• Diffraction radiation type: CuKa
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No