Information card for entry 7134902

Structure parameters

• Chemical name: [Ru(py3tpy)2](PF6)2
• Formula: C67 H60 F12 N12 O3 P2 Ru
• Calculated formula: C67 H56 F12 N12 O3 P2 Ru
• Title of publication: A ruthenium terpyridine complex showing stable photocatalytic hydrogen evolution under red light.
• Authors of publication: Mercier, Gabriel M.; Rousset, Elodie; Oubaha, Ilyes; Bandyopadhyay, Kamalika; Pal, Amlan K.; Ciofini, Ilaria; Chamoreau, Lise-Marie; Marvaud, Valérie; Hanan, Garry S.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2025
• Journal volume: 61
• Journal issue: 77
• Pages of publication: 14911 - 14914
• a: 15.521 ± 0.0007 Å
• b: 23.4518 ± 0.001 Å
• c: 20.2925 ± 0.0009 Å
• α: 90°
• β: 91 ± 0.003°
• γ: 90°
• Cell volume: 7385.3 ± 0.6 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1184
• Residual factor for significantly intense reflections: 0.0815
• Weighted residual factors for significantly intense reflections: 0.2248
• Weighted residual factors for all reflections included in the refinement: 0.268
• Goodness-of-fit parameter for all reflections included in the refinement: 1.104
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No