Information card for entry 4309457

Structure parameters

• Formula: C78 H49 Cu3 F18 N15 P3
• Calculated formula: C78 H49 Cu3 F18 N15 P3
• Title of publication: 2,2';9',2''-Ter[1,10]phenanthroline
• Authors of publication: Ruifa Zong; Randolph P. Thummel
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 5984 - 5986
• a: 13.7084 ± 0.0007 Å
• b: 16.0177 ± 0.0008 Å
• c: 18.463 ± 0.0009 Å
• α: 100.631 ± 0.001°
• β: 103.373 ± 0.001°
• γ: 107.167 ± 0.001°
• Cell volume: 3626.4 ± 0.3 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0493
• Residual factor for significantly intense reflections: 0.0355
• Weighted residual factors for significantly intense reflections: 0.0898
• Weighted residual factors for all reflections included in the refinement: 0.1012
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No