Information card for entry 7039326

Structure parameters

• Formula: C114 H102 F12 N12 O12 P2 Ru
• Calculated formula: C114 H102 F12 N12 O12 P2 Ru
• Title of publication: Ruthenium-tris(bipyridine) complexes with multiple redox-active amine substituents: tuning of spin density distribution and deep-red to NIR electrochromism and electrofluorochromism.
• Authors of publication: Nie, Hai-Jing; Yang, Wen-Wen; Shao, Jiang-Yang; Zhong, Yu-Wu
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 25
• Pages of publication: 10136 - 10140
• a: 17.177 ± 0.005 Å
• b: 20.069 ± 0.006 Å
• c: 20.907 ± 0.005 Å
• α: 74.84 ± 0.015°
• β: 65.94 ± 0.011°
• γ: 89.11 ± 0.018°
• Cell volume: 6318 ± 3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.1501
• Residual factor for significantly intense reflections: 0.1075
• Weighted residual factors for significantly intense reflections: 0.256
• Weighted residual factors for all reflections included in the refinement: 0.2807
• Goodness-of-fit parameter for all reflections included in the refinement: 1.151
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No