Information card for entry 7211513

Structure parameters

• Common name: cyclomaltoheptaose + 1-(hexahydro-1H-azepin-1-yl)-3-(p- toluenesulfonyl)urea inclusion complex
• Chemical name: cyclomaltoheptaose + 1-(hexahydro-1H-azepin-1-yl)-3- (p-toluenesulfonyl)urea inclusion complex
• Formula: C188.52 H206.8 N4.56 O174.48 S1.52
• Calculated formula: C47.13 H51.7 N1.14 O43.62 S0.38
• Title of publication: Similar modes of inclusion in complexes of β-cyclodextrin with sulfonylurea hypoglycemic drugs
• Authors of publication: Paulidou, Anastasia; Maffeo, Davide; Yannakopoulou, Konstantina; Mavridis, Irene M.
• Journal of publication: CrystEngComm
• Year of publication: 2010
• Journal volume: 12
• Journal issue: 2
• Pages of publication: 517
• a: 18.497 ± 0.005 Å
• b: 24.186 ± 0.006 Å
• c: 15.336 ± 0.006 Å
• α: 90 ± 0.04°
• β: 111.13 ± 0.03°
• γ: 90 ± 0.03°
• Cell volume: 6400 ± 4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.079
• Residual factor for significantly intense reflections: 0.0784
• Weighted residual factors for significantly intense reflections: 0.2183
• Weighted residual factors for all reflections included in the refinement: 0.2199
• Goodness-of-fit parameter for all reflections included in the refinement: 1.24
• Diffraction radiation wavelength: 0.8015 Å
• Diffraction radiation type: SYNCHROTRON
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No