Crystal structure and Hirshfeld surface analysis of 1-{[2-oxo-3-(prop-1-en-2-yl)-2,3-di­hydro-1H-1,3-benzo­diazol-1-yl]meth­yl}-3-(prop-1-en-2-yl)-2,3-di­hydro-1H-1,3-benzo­diazol-2-one

Saber, A.; Sebbar, N.K.; Hökelek, T.; Hni, B.; Mague, J.T.; Essassi, E.M.

doi:10.1107/S2056989018015219

Acta Crystallographica Section E
Acta Crystallographica
Section E CRYSTALLOGRAPHIC COMMUNICATIONS

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Figure 4
View of the three-dimensional Hirshfeld surface of the title compound plotted over electrostatic potential energy in the range −0.0500 to 0.0500 a.u. using the STO-3 G basis set at the Hartree–Fock level of theory. Hydrogen-bond donors and acceptors are shown as blue and red regions, respectively, around the atoms corresponding to positive and negative potentials.

CRYSTALLOGRAPHIC
COMMUNICATIONS

ISSN: 2056-9890

Volume 74| Part 12| December 2018| Pages 1746-1750

https://doi.org/10.1107/S2056989018015219

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