Information card for entry 2231272

Structure parameters

• Chemical name: Bis[1-benzyl-3-(4-methylphenyl)imidazol-2-ylidene]silver(I) hexafluoridophosphate
• Formula: C34 H32 Ag F6 N4 P
• Calculated formula: C34 H32 Ag F6 N4 P
• SMILES: [Ag](=C1N(Cc2ccccc2)C=CN1c1ccc(cc1)C)=C1N(Cc2ccccc2)C=CN1c1ccc(cc1)C.[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Bis[1-benzyl-3-(4-methylphenyl)imidazol-2-ylidene]silver(I) hexafluoridophosphate
• Authors of publication: Huang, Kun; Qin, Da-Bin
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 8
• Pages of publication: m1116
• a: 9.692 ± 0.002 Å
• b: 16.312 ± 0.004 Å
• c: 20.227 ± 0.005 Å
• α: 90°
• β: 93.469 ± 0.003°
• γ: 90°
• Cell volume: 3191.9 ± 1.3 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0361
• Residual factor for significantly intense reflections: 0.0309
• Weighted residual factors for significantly intense reflections: 0.0787
• Weighted residual factors for all reflections included in the refinement: 0.0809
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes