Information card for entry 1100313

Structure parameters

• Formula: C26 H29 N O
• Calculated formula: C26 H29 N O
• SMILES: OC[C@@H](C=C)[C@H](N(Cc1ccccc1)Cc1ccccc1)Cc1ccccc1.OC[C@H](C=C)[C@@H](N(Cc1ccccc1)Cc1ccccc1)Cc1ccccc1
• Title of publication: Asymmetric Induction in the Wittig-Still Rearrangement of Ethers Containing an Allylic Stereocenter ‒ Diastereocontrol by Allylic Nitrogen
• Authors of publication: Priepke, Henning; Brückner, Reinhard; Harms, Klaus
• Journal of publication: Chemische Berichte
• Year of publication: 1990
• Journal volume: 123
• Journal issue: 3
• Pages of publication: 555 - 563
• a: 9.425 ± 0.002 Å
• b: 9.49 ± 0.002 Å
• c: 12.386 ± 0.001 Å
• α: 94.741 ± 0.001°
• β: 97.68 ± 0.01°
• γ: 102.49 ± 0.01°
• Cell volume: 1064.78 ų
• Number of distinct elements: 4
• 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