Information card for entry 7104421

Structure parameters

• Formula: C26 H42 O4 Rh2 S2
• Calculated formula: C26 H42 O4 Rh2 S2
• SMILES: [Rh]1234567([Rh]89%10%11(S(S1(=O)=O)(=O)=O)([c]1([c]8([c]9([c]%10([c]%111C)C)C)C)CCC)(C6)C7)[c]1([c]2([c]3([c]4([c]51C)C)C)C)CCC
• Title of publication: The absolute asymmetric photoisomerization of a photochromic dithionite complex in chiral crystals.
• Authors of publication: Nakai, Hidetaka; Hatake, Mayu; Miyano, Yousuke; Isobe, Kiyoshi
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2009
• Journal volume: 34
• Journal issue: 19
• Pages of publication: 2685 - 2687
• a: 9.0049 ± 0.0007 Å
• b: 13.4615 ± 0.0011 Å
• c: 22.2113 ± 0.0018 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2692.4 ± 0.4 ų
• Cell temperature: 123.1 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for significantly intense reflections: 0.0297
• Weighted residual factors for all reflections included in the refinement: 0.0664
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No