Information card for entry 4347190

Structure parameters

• Formula: C70 H52 F16 N4 O10 Ru2
• Calculated formula: C70 H52 F16 N4 O10 Ru2
• Title of publication: Tuning of Stepwise Neutral-Ionic Transitions by Acceptor Site Doping in Alternating Donor/Acceptor Chains.
• Authors of publication: Nakabayashi, Keita; Nishio, Masaki; Miyasaka, Hitoshi
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 5
• Pages of publication: 2473 - 2480
• a: 10.636 ± 0.004 Å
• b: 10.845 ± 0.005 Å
• c: 15.399 ± 0.006 Å
• α: 88.253 ± 0.017°
• β: 70.49 ± 0.013°
• γ: 88.656 ± 0.017°
• Cell volume: 1673.3 ± 1.2 ų
• Cell temperature: 103 K
• Ambient diffraction temperature: 103 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1055
• Residual factor for significantly intense reflections: 0.0655
• Weighted residual factors for significantly intense reflections: 0.1192
• Weighted residual factors for all reflections included in the refinement: 0.1385
• Goodness-of-fit parameter for all reflections included in the refinement: 1.087
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No