Information card for entry 7120279

Structure parameters

• Chemical name: Bis(cyclo-1,4,7,10,13,16-hexaoxy-octakiadecane-rubidium)- diindeno[1,2,3-fg:1',2',3'-op]tetracene tetrahydrofuran solute
• Formula: C62 H80 O14 Rb2
• Calculated formula: C62 H80 O14 Rb2
• Title of publication: Organometallic rubidium and cesium compounds of the 5,6;11,12-di-o-phenylene-tetracene dianion
• Authors of publication: Wombacher, T.; Goddard, R.; Lehmann, C. W.; Schneider, J. J.
• Journal of publication: Chem. Commun.
• Year of publication: 2017
• a: 10.9805 ± 0.0018 Å
• b: 12.636 ± 0.002 Å
• c: 22.734 ± 0.004 Å
• α: 98.144 ± 0.003°
• β: 97.696 ± 0.003°
• γ: 109.057 ± 0.003°
• Cell volume: 2896.2 ± 0.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1123
• Residual factor for significantly intense reflections: 0.0494
• Weighted residual factors for significantly intense reflections: 0.1132
• Weighted residual factors for all reflections included in the refinement: 0.1427
• Goodness-of-fit parameter for all reflections included in the refinement: 0.854
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No