Information card for entry 4021127

Structure parameters

• Formula: C27 H24 N6 O3
• Calculated formula: C27 H24 N6 O3
• SMILES: N(C(=O)c1cc(cc(c1)C(=O)Nc1nccc(c1)C)C(=O)Nc1nccc(c1)C)c1nccc(c1)C
• Title of publication: Molecular Recognition of Carbohydrates with Acyclic Pyridine-Based Receptors
• Authors of publication: Monika Mazik; Wolfgang Radunz; Roland Boese
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2004
• Journal volume: 69
• Pages of publication: 7448 - 7462
• a: 8.5933 ± 0.0013 Å
• b: 11.568 ± 0.0017 Å
• c: 24.985 ± 0.004 Å
• α: 81.38 ± 0.003°
• β: 81.034 ± 0.003°
• γ: 78.366 ± 0.003°
• Cell volume: 2384.8 ± 0.6 ų
• Cell temperature: 203 ± 2 K
• Ambient diffraction temperature: 203 ± 2 K
• 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