Information card for entry 1515585

Structure parameters

• Formula: C38 H34 B Cu F4 N5 P
• Calculated formula: C38 H34 B Cu F4 N5 P
• SMILES: [F-][B](F)(F)F.Cc1cc(C)c2c(n1)[n]1c(cc2)Nc2[n]([Cu]1[P](c1ccccc1)(c1ccccc1)c1ccccc1)c1nc(C)cc(c1cc2)C
• Title of publication: Nanostructures of tetranuclear copper(i) complexes with short Cu(i)⋯Cu(i) contacts: crystallization-induced emission enhancement
• Authors of publication: Chen, Yong; Li, Jun-Li; Tong, Glenna So Ming; Lu, Wei; Fu, Wen-Fu; Lai, Siu-Wai; Che, Chi-Ming
• Journal of publication: Chemical Science
• Year of publication: 2011
• Journal volume: 2
• Journal issue: 8
• Pages of publication: 1509
• a: 8.485 ± 0.002 Å
• b: 13.769 ± 0.002 Å
• c: 15.231 ± 0.003 Å
• α: 91.11 ± 0.002°
• β: 100.453 ± 0.003°
• γ: 91.01 ± 0.002°
• Cell volume: 1749.2 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0824
• Residual factor for significantly intense reflections: 0.0513
• Weighted residual factors for significantly intense reflections: 0.127
• Weighted residual factors for all reflections included in the refinement: 0.152
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No