Information card for entry 4321267

Structure parameters

• Common name: [HB(3,5-(CF3)2Pz)3]CuN3Ad/0.5(C7H8)
• Formula: C28.5 H23 B Cu F18 N9
• Calculated formula: C28.5 H23 B Cu F18 N9
• Title of publication: Copper and Silver Complexes Containing Organic Azide Ligands: Syntheses, Structures, and Theoretical Investigation of [HB(3,5-(CF3)2Pz)3]CuNNN(1-Ad) and [HB(3,5-(CF3)2Pz)3]AgN(1-Ad)NN (Where Pz = Pyrazolyl and 1-Ad = 1-Adamantyl)
• Authors of publication: H. V. Rasika Dias; Sharon A. Polach; Sor-Koon Goh; Edet F. Archibong; Dennis S. Marynick
• Journal of publication: Inorganic Chemistry
• Year of publication: 2000
• Journal volume: 39
• Pages of publication: 3894 - 3901
• a: 10.4911 ± 0.0012 Å
• b: 11.4778 ± 0.0012 Å
• c: 16.139 ± 0.002 Å
• α: 99.621 ± 0.01°
• β: 108.817 ± 0.011°
• γ: 90.081 ± 0.009°
• Cell volume: 1810.4 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0458
• Residual factor for significantly intense reflections: 0.0374
• Weighted residual factors for significantly intense reflections: 0.0957
• Weighted residual factors for all reflections included in the refinement: 0.1019
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No