Information card for entry 2208678

Structure parameters

• Chemical name: Bis(4'-phenyl-2,2':6',2''-terpyridine- κ^3^<i>N</i>,<i>N</i>',<i>N</i>'')copper(II) bis(tetrafluoroborate)
• Formula: C42 H30 B2 Cu F8 N6
• Calculated formula: C42 H30 B2 Cu F8 N6
• Title of publication: Bis(4'-phenyl-2,2':6',2''-terpyridine-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'')copper(II) bis(tetrafluoroborate)
• Authors of publication: Toscano, Rubén A.; Martínez-Vargas, Sergio; Valdés-Martínez, Jesús
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 4
• Pages of publication: m846 - m848
• a: 9.4054 ± 0.0004 Å
• b: 12.8726 ± 0.0006 Å
• c: 31.52 ± 0.001 Å
• α: 90°
• β: 98.354 ± 0.001°
• γ: 90°
• Cell volume: 3775.7 ± 0.3 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 6
• 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: 0.073
• Residual factor for significantly intense reflections: 0.0466
• Weighted residual factors for significantly intense reflections: 0.0945
• Weighted residual factors for all reflections included in the refinement: 0.1018
• Goodness-of-fit parameter for all reflections included in the refinement: 0.876
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No