Information card for entry 7114407

Structure parameters

• Formula: C10 H20 Cu F6 N7 O4 P
• Calculated formula: C10 H20 Cu F6 N7 O4 P
• Title of publication: A proton induced conformational change in metal complexes with potential hydrogen bonding triplet motifs
• Authors of publication: Atkinson, Ian M.; Bishop, Michael M.; Lindoy, Leonard F.; Mahadev, Srihari; Turner, Peter
• Journal of publication: Chemical Communications
• Year of publication: 2002
• Journal issue: 23
• Pages of publication: 2818
• a: 12.334 ± 0.002 Å
• b: 12.456 ± 0.002 Å
• c: 6.8257 ± 0.0013 Å
• α: 95.855 ± 0.003°
• β: 104.966 ± 0.003°
• γ: 90.591 ± 0.003°
• Cell volume: 1007.1 ± 0.3 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 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: 0.0675
• Residual factor for significantly intense reflections: 0.059
• Weighted residual factors for significantly intense reflections: 0.1786
• Weighted residual factors for all reflections included in the refinement: 0.1893
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No