Information card for entry 4345629

Structure parameters

• Formula: C30.5 H32 F6 N5 O1.5 P Ru S
• Calculated formula: C30.5 H30 F6 N5 O1.5 P Ru S
• Title of publication: Synthesis and Photobiological Activity of Ru(II) Dyads Derived from Pyrrole-2-carboxylate Thionoesters.
• Authors of publication: Smithen, Deborah A.; Yin, Huimin; Beh, Michael H. R.; Hetu, Marc; Cameron, T. Stanley; McFarland, Sherri A.; Thompson, Alison
• Journal of publication: Inorganic chemistry
• Year of publication: 2017
• Journal volume: 56
• Journal issue: 7
• Pages of publication: 4121 - 4132
• a: 21.9599 ± 0.0009 Å
• b: 13.8939 ± 0.0004 Å
• c: 24.2344 ± 0.001 Å
• α: 90°
• β: 115.971 ± 0.0015°
• γ: 90°
• Cell volume: 6647.4 ± 0.4 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 K
• Number of distinct elements: 8
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for significantly intense reflections: 0.0517
• Weighted residual factors for all reflections included in the refinement: 0.1642
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No