Information card for entry 7014756

Structure parameters

• Common name: Compound 2
• Formula: C8 H F4 N O2
• Calculated formula: C8 H F4 N O2
• SMILES: c1(F)c(F)c(F)c(F)c2C(=O)NC(=O)c12
• Title of publication: Synthesis and structures of gold perfluorophthalimido complexes.
• Authors of publication: Savjani, Nicky; Lancaster, Simon J.; Bew, Sean; Hughes, David L.; Bochmann, Manfred
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 5
• Pages of publication: 1079 - 1090
• a: 12.052 ± 0.0005 Å
• b: 5.4998 ± 0.0002 Å
• c: 11.4291 ± 0.0004 Å
• α: 90°
• β: 94.626 ± 0.004°
• γ: 90°
• Cell volume: 755.09 ± 0.05 ų
• Cell temperature: 140 ± 1 K
• Ambient diffraction temperature: 140 ± 1 K
• Number of distinct elements: 5
• 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: 0.056
• Residual factor for significantly intense reflections: 0.0436
• Weighted residual factors for significantly intense reflections: 0.097
• Weighted residual factors for all reflections included in the refinement: 0.1028
• Goodness-of-fit parameter for all reflections included in the refinement: 1.129
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No