Information card for entry 7202705

Structure parameters

• Formula: C38 H38 N4 O5
• Calculated formula: C38 H38 N4 O5
• SMILES: c1(cccc2c1nccc2)OCC(=O)Nc1c(cccc1C)C.O
• Title of publication: Structural aspects and properties of salt and inclusion compounds of 8-hydroxyquinoline based amides
• Authors of publication: Karmakar, Anirban; Sarma, Rupam J.; Baruah, Jubaraj B.
• Journal of publication: CrystEngComm
• Year of publication: 2007
• Journal volume: 9
• Journal issue: 5
• Pages of publication: 379
• a: 11.4032 ± 0.0005 Å
• b: 11.4631 ± 0.0005 Å
• c: 15.0226 ± 0.0007 Å
• α: 80.782 ± 0.003°
• β: 72.286 ± 0.003°
• γ: 68.221 ± 0.003°
• Cell volume: 1734.59 ± 0.14 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1814
• Residual factor for significantly intense reflections: 0.0688
• Weighted residual factors for significantly intense reflections: 0.1241
• Weighted residual factors for all reflections included in the refinement: 0.1641
• Goodness-of-fit parameter for all reflections included in the refinement: 0.984
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No