Information card for entry 7118783

Structure parameters

• Chemical name: 1_Pen
• Formula: C30 H50 O4 Rh2 S2
• Calculated formula: C30 H50 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)CCCCC)(C6)C7)[c]1([c]5([c]4([c]3([c]21C)C)C)C)CCCCC
• Title of publication: Photoinduced bending of rod-like millimetre-size crystals of a rhodium dithionite complex with n-pentyl moieties.
• Authors of publication: Nakai, Hidetaka; Matsuba, Kengo; Akimoto, Masataka; Nozaki, Tomonori; Matsumoto, Takahiro; Isobe, Kiyoshi; Irie, Masahiro; Ogo, Seiji
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2016
• Journal volume: 52
• Journal issue: 23
• Pages of publication: 4349 - 4352
• a: 13.97 ± 0.006 Å
• b: 25.545 ± 0.01 Å
• c: 8.975 ± 0.004 Å
• α: 90°
• β: 97.362 ± 0.005°
• γ: 90°
• Cell volume: 3176 ± 2 ų
• Cell temperature: 108 K
• Ambient diffraction temperature: 108 K
• Number of distinct elements: 5
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0338
• Residual factor for significantly intense reflections: 0.0311
• Weighted residual factors for significantly intense reflections: 0.0649
• Weighted residual factors for all reflections included in the refinement: 0.0664
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No