Information card for entry 7700647

Structure parameters

• Chemical name: Ir(phenylisoquinoline)2(2,2,4,4 terpyridine)PF6
• Formula: C37 H27 F6 Ir N5 P
• Calculated formula: C37 H27 F6 Ir N5 P
• Title of publication: Design and photophysical studies of iridium(iii)-cobalt(iii) dyads and their application for dihydrogen photo-evolution.
• Authors of publication: Lentz, Cédric; Schott, Olivier; Auvray, Thomas; Hanan, Garry S.; Elias, Benjamin
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 41
• Pages of publication: 15567 - 15576
• a: 20.5798 ± 0.0019 Å
• b: 24.646 ± 0.002 Å
• c: 14.4517 ± 0.0013 Å
• α: 90°
• β: 108.834 ± 0.004°
• γ: 90°
• Cell volume: 6937.6 ± 1.1 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.081
• Residual factor for significantly intense reflections: 0.071
• Weighted residual factors for significantly intense reflections: 0.1757
• Weighted residual factors for all reflections included in the refinement: 0.1835
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.34139 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No