Information card for entry 7155995

Structure parameters

• Formula: C19 H19.5 N2.5 O3
• Calculated formula: C19 H19.5 N2.5 O3
• Title of publication: Design, synthesis, and conformational analysis of 3-cyclo-butylcarbamoyl hydantoins as novel hydrogen bond driven universal peptidomimetics.
• Authors of publication: Bellucci, M. C.; Frigerio, M.; Castellano, C.; Meneghetti, F.; Sacchetti, A.; Volonterio, A.
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2018
• Journal volume: 16
• Journal issue: 4
• Pages of publication: 521 - 525
• a: 9.7379 ± 0.0019 Å
• b: 13.134 ± 0.003 Å
• c: 14.204 ± 0.003 Å
• α: 74.4 ± 0.03°
• β: 79.76 ± 0.03°
• γ: 87.25 ± 0.03°
• Cell volume: 1721.9 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.1371
• Residual factor for significantly intense reflections: 0.0837
• Weighted residual factors for significantly intense reflections: 0.2141
• Weighted residual factors for all reflections included in the refinement: 0.2487
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No