Information card for entry 4313726

Structure parameters

• Chemical name: Diphenyldichlorophosphonium trichloride chlorine solvate 1:1
• Formula: C12 H10 Cl5.73 P
• Calculated formula: C12 H10 Cl5.732 P
• Title of publication: Diphenyldichlorophosphonium Trichloride-Chlorine Solvate 1:1, [PPh2Cl2]+Cl3-.Cl2: An Ionic Form of Diphenyltrichlorophosphorane. Crystal Structures of [PPh2Cl2]+Cl3-.Cl2 and [(PPh2Cl2)+]2[InCl5]2-
• Authors of publication: Jan Taraba; Zdirad Zak
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 3591 - 3594
• a: 22.689 ± 0.005 Å
• b: 8.8 ± 0.002 Å
• c: 7.994 ± 0.002 Å
• α: 90°
• β: 93.09 ± 0.03°
• γ: 90°
• Cell volume: 1593.8 ± 0.6 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 4
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.0567
• Residual factor for significantly intense reflections: 0.048
• Weighted residual factors for significantly intense reflections: 0.1176
• Weighted residual factors for all reflections included in the refinement: 0.1236
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No