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Updated: Jul 31, 2025
Construction and Systematical Symmetric Studies of a Series of Supramolecular Clusters with Binary or Ternary Ammonium Triphenylacetates
Published on: February 15, 2016
Structural, Hirshfeld surface and three-dimensional inter-action-energy studies of 1,3,5-triethyl
S N Chandana1,2, D P Ganesha1,2, N R Sreenatha3
1Department of Physics, Adichunchanagiri Institute of Technology, Chikkamagaluru 577102, Karnataka, India.
Abstract:
In the title compound, C29H27F2N3O6, which crystallizes in the monoclinic space group P21/c, the cyclo-hexenone ring is puckered and adopts an envelope conformation. The crystal structure features various inter-molecular inter-actions, such as N-H⋯O, C-H⋯N and C-H⋯O. These inter-actions were investigated using Hirshfeld surface analysis and the three-dimensional inter-action energies were calculated using the B3LYP/6-31 G(d,p) energy density model.
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