Information card for entry 7200767

Structure parameters

• Common name: [Cu(terpyPh)2](PF6)2.4DMF
• Formula: C54 H58 Cu F12 N10 O4 P2
• Calculated formula: C54 H58 Cu F12 N10 O4 P2
• Title of publication: Crystal packing in metal complexes of 4′-phenylterpyridine and related ligands: occurrence of the 2D and 1D terpy embrace arrays
• Authors of publication: McMurtrie, John; Dance, Ian
• Journal of publication: CrystEngComm
• Year of publication: 2009
• Journal volume: 11
• Journal issue: 6
• Pages of publication: 1141
• a: 8.7021 ± 0.0017 Å
• b: 34.037 ± 0.006 Å
• c: 9.6217 ± 0.0018 Å
• α: 90°
• β: 93.538 ± 0.003°
• γ: 90°
• Cell volume: 2844.5 ± 0.9 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0529
• Residual factor for significantly intense reflections: 0.0492
• Weighted residual factors for significantly intense reflections: 0.1034
• Weighted residual factors for all reflections included in the refinement: 0.1054
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No