Information card for entry 2211772

Structure parameters

• Chemical name: Triphenylphosphonium perchlorate
• Formula: C18 H16 Cl O4 P
• Calculated formula: C18 H16 Cl O4 P
• SMILES: c1(ccccc1)[PH+](c1ccccc1)c1ccccc1.[O-]Cl(=O)(=O)=O
• Title of publication: Triphenylphosphonium perchlorate
• Authors of publication: Jing Zhu; Ji-Xiang Dai; Qian-Feng Zhang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 1
• Pages of publication: o363 - o364
• a: 10.6695 ± 0.0018 Å
• b: 13.113 ± 0.002 Å
• c: 12.488 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1747.2 ± 0.5 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 5
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0726
• Residual factor for significantly intense reflections: 0.0529
• Weighted residual factors for significantly intense reflections: 0.134
• Weighted residual factors for all reflections included in the refinement: 0.1488
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes