Information card for entry 4029396

Structure parameters

• Formula: C30 H26
• Calculated formula: C30 H26
• SMILES: C1(=Cc2c(cc(cc2)C)[C@H]([C@@H]1c1ccccc1)c1ccc(cc1)C)c1ccccc1.C1(=Cc2c(cc(cc2)C)[C@@H]([C@H]1c1ccccc1)c1ccc(cc1)C)c1ccccc1
• Title of publication: Biomimetic oxidative dimerization of anodically generated stilbene radical cations: effect of aromatic substitution on product distribution and reaction pathways.
• Authors of publication: Hong, Fong-Jiao; Low, Yun-Yee; Chong, Kam-Weng; Thomas, Noel F.; Kam, Toh-Seok
• Journal of publication: The Journal of organic chemistry
• Year of publication: 2014
• Journal volume: 79
• Journal issue: 10
• Pages of publication: 4528 - 4543
• a: 11.2069 ± 0.0002 Å
• b: 11.0239 ± 0.0002 Å
• c: 18.5291 ± 0.0004 Å
• α: 90°
• β: 90.694 ± 0.001°
• γ: 90°
• Cell volume: 2288.99 ± 0.08 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 2
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0691
• Residual factor for significantly intense reflections: 0.0478
• Weighted residual factors for significantly intense reflections: 0.145
• Weighted residual factors for all reflections included in the refinement: 0.1654
• Goodness-of-fit parameter for all reflections included in the refinement: 1.127
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No