Information card for entry 2312348

Structure parameters

• Chemical name: <i>N</i>-Triphenylacetyl-<i>L</i>-tyrosine dichloromethane monosolvate
• Formula: C30 H27 Cl2 N O4
• Calculated formula: C30 H27 Cl2 N O4
• Title of publication: Diversity of N-triphenylacetyl-L-tyrosine solvates with halogenated solvents.
• Authors of publication: Czapik, Agnieszka; Kwit, Marcin
• Journal of publication: Acta crystallographica. Section C, Structural chemistry
• Year of publication: 2021
• Journal volume: 77
• Journal issue: Pt 12
• Pages of publication: 745 - 756
• a: 10.04475 ± 0.00013 Å
• b: 9.82563 ± 0.00012 Å
• c: 14.59465 ± 0.00018 Å
• α: 90°
• β: 108.742 ± 0.0013°
• γ: 90°
• Cell volume: 1364.05 ± 0.03 ų
• Cell temperature: 130 ± 2 K
• Ambient diffraction temperature: 130 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0395
• Residual factor for significantly intense reflections: 0.0351
• Weighted residual factors for significantly intense reflections: 0.0929
• Weighted residual factors for all reflections included in the refinement: 0.0951
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes