Information card for entry 2203436

Structure parameters

• Chemical name: Bis{5-methyl-4-[(Z)-(1-naphthylamino)phenylmethylene]-2-phenyl-3H-pyrazol- 3-one-κ^2^N,N'}silver(I) hexafluorophosphate
• Formula: C54 H42 Ag F6 N6 O2 P
• Calculated formula: C54 H42 Ag F6 N6 O2 P
• SMILES: c1(ccccc1)N1C(=O)C(=C(N1[Ag]N1C(=C(C(=O)N1c1ccccc1)/C(=[NH+]/c1cccc2ccccc12)c1ccccc1)C)C)C(=[NH+]\c1cccc2ccccc12)\c1ccccc1.[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Bis{5-methyl-4-[(<i>Z</i>)-(1-naphthylamino)phenylmethylene]-2-phenyl-3<i>H</i>-pyrazol-3-one-κ^2^<i>N</i>,<i>N</i>'}silver(I) hexafluorophosphate
• Authors of publication: Lü, Xingqiang; Bao, Feng; Wu, Qing; Kang, Beisheng; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 4
• Pages of publication: m362 - m363
• a: 9.655 ± 0.001 Å
• b: 10.859 ± 0.001 Å
• c: 11.384 ± 0.001 Å
• α: 88.695 ± 0.002°
• β: 79.453 ± 0.002°
• γ: 88.84 ± 0.002°
• Cell volume: 1172.91 ± 0.19 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.055
• Residual factor for significantly intense reflections: 0.037
• Weighted residual factors for significantly intense reflections: 0.091
• Weighted residual factors for all reflections included in the refinement: 0.097
• Goodness-of-fit parameter for all reflections included in the refinement: 0.91
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes