Information card for entry 7057974

Structure parameters

• Formula: C208 H352 Cl2 O44 Ru4
• Calculated formula: C207.996 H295.99 Cl2 O44 Ru4
• Title of publication: Magnetic and liquid-crystalline properties of chlorido- and cyanato-bridged chain complexes of mixed-valent dinuclear ruthenium(ii,iii) 3,4,5-trialkoxybenzoates
• Authors of publication: Ishida, Hideaki; Handa, Makoto; Hiromitsu, Ichiro; Ujiie, Seiji; Yoshioka, Daisuke; Mitsuhashi, Ryoji; Mikuriya, Masahiro
• Journal of publication: New Journal of Chemistry
• Year of publication: 2019
• Journal volume: 43
• Journal issue: 3
• Pages of publication: 1134
• a: 15.891 ± 0.003 Å
• b: 16.458 ± 0.003 Å
• c: 21.442 ± 0.003 Å
• α: 95.436 ± 0.002°
• β: 100.385 ± 0.002°
• γ: 93.743 ± 0.002°
• Cell volume: 5471.7 ± 1.6 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1825
• Residual factor for significantly intense reflections: 0.0892
• Weighted residual factors for significantly intense reflections: 0.2084
• Weighted residual factors for all reflections included in the refinement: 0.2654
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No