Crystal structure, Hirshfeld surface, DFT, mol­ecular docking of 1-[(6-tert-butyl-2-oxo-2H-chromen-4-yl)meth­yl]-4,4-di­methyl­piperidine-2,6-dione and cytotoxic effects on breast cancer (MDA-MB 231), human alveolar basal epithelial (A549) cell lines

Sunitha Kumari, M.; Harish Kumar, M.; Deevith, D.V.; Devarajegowda, H.C.; Palakshamurthy, B.S.

doi:10.1107/S2056989025001550

Acta Crystallographica Section E
Acta Crystallographica
Section E CRYSTALLOGRAPHIC COMMUNICATIONS

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Figure 7
Energy frameworks calculated for the title compound, showing (a) Coulomb force, (b) dispersion force and (c), (d) total energy diagrams. The cylindrical radii are proportional to the relative strength of the corresponding energies; they were adjusted to a cutoff value of 5 kJ mol⁻¹.

CRYSTALLOGRAPHIC
COMMUNICATIONS

ISSN: 2056-9890

Volume 81| Part 3| March 2025| Pages 257-263

https://doi.org/10.1107/S2056989025001550

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