Crystal structure, Hirshfeld surface and frontier mol­ecular orbital analysis of 10-benzyl-9-(4-hydroxy-3-meth­oxy­phen­yl)-3,3,6,6-tetra­methyl-3,4,6,7,9,10-hexa­hydro­acridine-1,8(2H,5H)-dione

Sughanya, V.; Loganathan, B.; Praveenkumar, D.; Ayyappan, J.; Sundararajan, M.L.; Prabhakaran, A.; Dhandapani, A.; Suresh Babu, N.

doi:10.1107/S2056989022006557

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 molecule plotted over electrostatic potential energy in the range −0.0500 to 0.0500 a.u. calculated with the STO-3 G basis set at the Hartree–Fock level of theory. The hydrogen-bond donating and acceptor areas are viewed as blue and red regions, respectively, around atoms, corresponding to positive and negative potentials.

CRYSTALLOGRAPHIC
COMMUNICATIONS

ISSN: 2056-9890

Volume 78| Part 8| August 2022| Pages 789-793

https://doi.org/10.1107/S2056989022006557

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