Crystal structure, Hirshfeld surface analysis, DFT and molecular docking studies of 4′-(benzyloxy)-[1,1′-biphenyl]-3-carboxylic acid

Crystal structure, Hirshfeld surface analysis, DFT and molecular docking studies of 4′-(benzyloxy)-[1,1′-biphenyl]-3-carboxylic acid

In the title compound, C20H16O3, intramolecular C— H...O hydrogen bonds are observed. The dihedral angles between the aromatic benzoic acid ring and the two adjacent aromatic rings are 26.09 (4) and 69.93 (8)°, while the dihedral angle between the aromatic rings connected by the C—O—C—C [torsion ang...

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Bibliographic Details
Main Authors:	M. Harish Kumar, M. Vinduvahini, H. T. Srinivasa, H. C. Devarajegowda, B. S. Palakshamurthy
Format:	Article
Language:	English
Published:	International Union of Crystallography 2025-03-01
Series:	Acta Crystallographica Section E: Crystallographic Communications
Subjects:	crystal structure hirshfeld surface dft studies molecular docking benzyloxy biphenyl carboxylic acid
Online Access:	https://journals.iucr.org/paper?S2056989025001021
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