Information card for entry 4021148

Structure parameters

• Formula: C30 H34 N2 O8 S2
• Calculated formula: C30 H34 N2 O8 S2
• SMILES: C1(=C2CN(CC2CC(=C1CN(CC=C)S(=O)(=O)c1ccc(cc1)C)C(=O)OC)S(=O)(=O)c1ccc(cc1)C)C(=O)OC
• Title of publication: Palladium(0)-Catalyzed Cyclization of Electron-Deficient Enynes and Enediynes
• Authors of publication: Yoshihiko Yamamoto; Shoji Kuwabara; Yoji Ando; Hitomi Nagata; Hisao Nishiyama; Kenji Itoh
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2004
• Journal volume: 69
• Pages of publication: 6697 - 6705
• a: 11.2372 ± 0.0005 Å
• b: 11.9537 ± 0.0006 Å
• c: 13.4405 ± 0.0007 Å
• α: 108.688 ± 0.001°
• β: 101.864 ± 0.001°
• γ: 110.031 ± 0.001°
• Cell volume: 1502.52 ± 0.13 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No