Information card for entry 2212395

Structure parameters

• Chemical name: (1,10-Phenanthroline-κ^2^N,N')(triphenylphosphine-κP)silver(I) perchlorate acetonitrile hemisolvate
• Formula: C31 H24.5 Ag Cl N2.5 O4 P
• Calculated formula: C30 H23 Ag Cl N2 O4 P
• SMILES: [Ag]1([n]2c3c4[n]1cccc4ccc3ccc2)[P](c1ccccc1)(c1ccccc1)c1ccccc1.Cl(=O)(=O)(=O)[O-]
• Title of publication: (1,10-Phenanthroline-κ^2^<i>N</i>,<i>N</i>')(triphenylphosphine-κ<i>P</i>)silver(I) perchlorate acetonitrile hemisolvate
• Authors of publication: Aliakbar Dehno Khalaji; Mehdi Amirnasr; Jean-Claude Daran
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 2
• Pages of publication: m309 - m311
• a: 16.6708 ± 0.0012 Å
• b: 22.9245 ± 0.0017 Å
• c: 14.7068 ± 0.0013 Å
• α: 90°
• β: 94.063 ± 0.006°
• γ: 90°
• Cell volume: 5606.4 ± 0.8 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 7
• 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: 0.1049
• Residual factor for significantly intense reflections: 0.0446
• Weighted residual factors for significantly intense reflections: 0.1075
• Weighted residual factors for all reflections included in the refinement: 0.1306
• Goodness-of-fit parameter for all reflections included in the refinement: 0.926
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes