Information card for entry 4316271

Structure parameters

• Formula: C24 H30 B Cl Cu F4 N4
• Calculated formula: C24 H30 B Cl Cu F4 N4
• SMILES: [B](F)(F)(F)[F-].c12ccccc1[N](C)(C)[Cu]13(Cl)[N]2(c2ccccc2[N]1(C)C)c1ccccc1[N]3(C)C
• Title of publication: Transition Metal Complexes Supported by a Neutral Tetraamine Ligand Containing N,N-dimethylaniline Units
• Authors of publication: Lei Chu; Kenneth I. Hardcastle; Cora E. MacBeth
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 7521 - 7529
• a: 9.0188 ± 0.0005 Å
• b: 21.9007 ± 0.0014 Å
• c: 12.4198 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2453.1 ± 0.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0659
• Residual factor for significantly intense reflections: 0.0558
• Weighted residual factors for significantly intense reflections: 0.1478
• Weighted residual factors for all reflections included in the refinement: 0.1552
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No