Information card for entry 4020568

Structure parameters

• Formula: C22 H22 N2 O
• Calculated formula: C22 H22 N2 O
• SMILES: C(C(=Cc1ccnc2ccccc12)c1ccccc1)(=NO)CCCC
• Title of publication: α,β-Unsaturated Ketoximes Carrying a Terminal Pyridine or Quinoline Subunit as Building Blocks for Supramolecular Syntheses
• Authors of publication: Monika Mazik; Dieter Bläser; Roland Boese
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2005
• Journal volume: 70
• Pages of publication: 9115 - 9122
• a: 5.519 ± 0.0008 Å
• b: 19.713 ± 0.004 Å
• c: 16.914 ± 0.002 Å
• α: 90°
• β: 98.725 ± 0.007°
• γ: 90°
• Cell volume: 1818.8 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No