The aim is to determine the crystal structure of (S)-3-phenyl-2-(pyrazine-2-carboxamido)propanoic acid.
Analyzed the crystal structure using X-ray diffraction.
Measured dimensions of the crystal in orthorhombic configuration.
Calculated unit cell parameters: a = 5.75430 Å, b = 8.6985 Å, c = 26.7068 Å.
The crystal exhibits an orthorhombic structure with cell volume V = 1336.78 ų.
Refinement indices R gt (F) = 0.0301 and wR ref (F²) = 0.0822 at 298 K for accurate modeling.
Structure provides insights for future applications in pharmaceuticals.
Abstract
Abstract C 14 H 13 N 3 O 3 , orthorhombic, P 2 1 2 1 2 1 (no. 19), a = 5.75430(10) Å, b = 8.6985(2) Å, c = 26.7068(6) Å, V = 1336.78(5) Å 3 , Z = 4, R gt ( F ) = 0.0301, wR ref ( F 2 ) = 0.0822, T = 298 K.