Information card for entry 2204031

Structure parameters

• Chemical name: (Acetonitrile-κN)(4'-phenyl-2,2':6',2''-terpyridine-κ^3^N)silver(I) hexafluorophosphate acetonitrile solvate
• Formula: C25 H21 Ag F6 N5 P
• Calculated formula: C25 H21 Ag F6 N5 P
• SMILES: [Ag]12([n]3ccccc3c3[n]1c(cc(c3)c1ccccc1)c1[n]2cccc1)[N]#CC.[P](F)(F)(F)(F)(F)[F-].N#CC
• Title of publication: (Acetonitrile-κ<i>N</i>)(4'-phenyl-2,2':6',2''-terpyridine-κ^3^<i>N</i>)silver(I) hexafluorophosphate acetonitrile solvate
• Authors of publication: Hou, Lei; Li, Dan; Yin, Ye-Gao; Wu, Tao; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 8
• Pages of publication: m1106 - m1107
• a: 16.777 ± 0.001 Å
• b: 7.8257 ± 0.0006 Å
• c: 19.447 ± 0.001 Å
• α: 90°
• β: 90.356 ± 0.002°
• γ: 90°
• Cell volume: 2553.2 ± 0.3 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.083
• Residual factor for significantly intense reflections: 0.057
• Weighted residual factors for significantly intense reflections: 0.153
• Weighted residual factors for all reflections included in the refinement: 0.178
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes