Information card for entry 4082702

Structure parameters

• Formula: C58 H58 F6 N4 O14 Ru2 S2
• Calculated formula: C58 H50 F6 N4 O14 Ru2 S2
• Title of publication: Coordination-Driven Self-Assembly and Anticancer Potency Studies of Arene‒Ruthenium-Based Molecular Metalla-Rectangles
• Authors of publication: Mishra, Anurag; Jeong, Yong Joon; Jo, Jae-Ho; Kang, Se Chan; Kim, Hyunuk; Chi, Ki-Whan
• Journal of publication: Organometallics
• Year of publication: 2014
• Journal volume: 33
• Journal issue: 5
• Pages of publication: 1144
• a: 13.777 ± 0.003 Å
• b: 13.963 ± 0.003 Å
• c: 18.59 ± 0.004 Å
• α: 109.07 ± 0.03°
• β: 98.42 ± 0.03°
• γ: 97.32 ± 0.03°
• Cell volume: 3284.2 ± 1.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.117
• Residual factor for significantly intense reflections: 0.1165
• Weighted residual factors for significantly intense reflections: 0.2884
• Weighted residual factors for all reflections included in the refinement: 0.29
• Goodness-of-fit parameter for all reflections included in the refinement: 1.588
• Diffraction radiation wavelength: 0.8 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No