Information card for entry 7200768

Structure parameters

• Common name: [Fe(terpyPh)2](PF6)2.4DMF
• Formula: C48 H44 F12 Fe N8 O2 P2
• Calculated formula: C48 H44 F12 Fe N8 O2 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: 8.7907 ± 0.001 Å
• b: 9.0547 ± 0.001 Å
• c: 30.257 ± 0.003 Å
• α: 96.778 ± 0.002°
• β: 92.357 ± 0.002°
• γ: 91.431 ± 0.002°
• Cell volume: 2388.4 ± 0.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.07
• Residual factor for significantly intense reflections: 0.0639
• Weighted residual factors for significantly intense reflections: 0.1313
• Weighted residual factors for all reflections included in the refinement: 0.1348
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No