Information card for entry 4021105

Structure parameters

• Formula: C32 H30
• Calculated formula: C32 H30
• SMILES: [C@@H]1([C@]2([C@]1([C@H]1[C@@H](C1)c1ccccc1)[C@@H]1C[C@H]2C=C1)c1ccccc1)[C@H]1[C@@H](C1)c1ccccc1
• Title of publication: Novel Ene Trimerization of 1-Phenylcyclopropene
• Authors of publication: Gon-Ann Lee; Chih-Yi Chang
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2004
• Journal volume: 69
• Pages of publication: 8949 - 8951
• a: 8.5785 ± 0.0008 Å
• b: 14.193 ± 0.003 Å
• c: 19.42 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2364.4 ± 0.7 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 2
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No