Information card for entry 4517288

Structure parameters

• Formula: C24 H32 Cu F6 N6 O9 P
• Calculated formula: C24 H32 Cu F6 N6 O9 P
• Title of publication: Influence of 2-Amino-4-methylpyridine and 2-Aminopyrimidine Ligands on the Malonic Acid-Cu(II) System: Insights through Supramolecular Interactions and Photoresponse Properties
• Authors of publication: Mandal, Tripti; Dey, Arka; Seth, Saikat Kumar; Ortega-Castro, Joaquín; Rheingold, Arnold L.; Ray, Partha Pratim; Frontera, Antonio; Mukhopadhyay, Subrata
• Journal of publication: ACS Omega
• Year of publication: 2019
• a: 9.8494 ± 0.0009 Å
• b: 10.0898 ± 0.0009 Å
• c: 17.7292 ± 0.0017 Å
• α: 86.873 ± 0.003°
• β: 75.394 ± 0.003°
• γ: 70.241 ± 0.002°
• Cell volume: 1603.7 ± 0.3 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 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: 0.0774
• Residual factor for significantly intense reflections: 0.0597
• Weighted residual factors for significantly intense reflections: 0.1503
• Weighted residual factors for all reflections included in the refinement: 0.1614
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Diffraction radiation X-ray symbol: K-L~3~
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No