Information card for entry 7027192

Structure parameters

• Common name: [LCu2](BF4)2-CH2Cl2
• Formula: C52 H59 B2 Cl2 Cu2 F8 N9
• Calculated formula: C52 H59 B2 Cl2 Cu2 F8 N9
• Title of publication: Co-ordination chemistry of CuI with 1,3,5-tris[bis(pyridin-2-ylmethyl)aminomethyl]-2,4,6-triethylbenzene, a conformationally constrained trinucleating ligand
• Authors of publication: Walsdorff, Christian; Park, Sunyoung; Kim, Jeongho; Heo, Jungseok; Park, Ki-Min; Oh, Jinho; Kim, Kimoon
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 1999
• Journal issue: 6
• Pages of publication: 923
• a: 10.034 ± 0.004 Å
• b: 27.69 ± 0.03 Å
• c: 19.83 ± 0.02 Å
• α: 90°
• β: 92.45 ± 0.05°
• γ: 90°
• Cell volume: 5505 ± 8 ų
• Cell temperature: 188 ± 2 K
• Ambient diffraction temperature: 188 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.13
• Residual factor for significantly intense reflections: 0.0783
• Weighted residual factors for significantly intense reflections: 0.1368
• Weighted residual factors for all reflections included in the refinement: 0.1602
• Goodness-of-fit parameter for all reflections included in the refinement: 1.181
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No