Information card for entry 7000654

Structure parameters

• Formula: C58 H50 B Cu F4 N9 O P
• Calculated formula: C54 H42 B Cu F4 N9 P
• Title of publication: Cu(i) and Ag(i) complexes of 7-azaindolyl and 2,2′-dipyridylamino substituted 1,3,5-triazine and benzene: the central core impact on structure, solution dynamics and fluorescence of the complexes
• Authors of publication: Wong, Elizabeth; Li, John; Seward, Corey; Wang, Suning
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 10
• Pages of publication: 1776 - 1785
• a: 11.257 ± 0.0001 Å
• b: 15.4097 ± 0.0002 Å
• c: 15.5266 ± 0.0002 Å
• α: 81.52 ± 0.001°
• β: 85.32 ± 0.001°
• γ: 69.188 ± 0.001°
• Cell volume: 2488.85 ± 0.05 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.047
• Residual factor for significantly intense reflections: 0.0391
• Weighted residual factors for significantly intense reflections: 0.1122
• Weighted residual factors for all reflections included in the refinement: 0.1165
• 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