Abstract
Specific features of the molecular and crystal structures of two substituted benzoxazinones (I and II) and their structural analog quinazolinone (III) have been analyzed by the XRD method. Compound I exists in two crystalline modifications. All investigated molecules are nonplanar; however, the character of their nonplanarity is different. In molecules I and II, the intramolecular hydrogen bond N–H⋅⋅⋅N rather than the potentially possible bond N–H⋅⋅⋅О is closed. Molecule III also contains the similar hydrogen bond. The occurrence of weak directional interactions in the crystal packings (π–π interactions in I and II and intermolecular hydrogen bonds N–Н⋅⋅⋅O in III) leads to the formation of isolated dimer structures rather than infinite formations.
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Kuz’mina, L.G., Salykin, S.Y., Kulagin, S.V. et al. Crystal Structures of N-[2-(4-oxo-4H-benzo[d] [1, 3]-oxazin-2-yl)benzamide and Propionamide and Their N-Containing Analog N-[2-(4-oxo-3,4-dihydroquinazolin-2-yl)phenyl]propionamide. Crystallogr. Rep. 66, 413–419 (2021). https://doi.org/10.1134/S1063774521030135
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DOI: https://doi.org/10.1134/S1063774521030135