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Synthesis, crystal structure and Hirshfeld surface analysis of naphthalene-2,3-diyl bis-(3-benz-yl-oxy)benzoate.

Authors :
Anil Kumar H
Selvanandan S
Srinivasa HT
Venkateshappa G
Palakshamurthy BS
Source :
Acta crystallographica. Section E, Crystallographic communications [Acta Crystallogr E Crystallogr Commun] 2023 Jul 04; Vol. 79 (Pt 8), pp. 686-689. Date of Electronic Publication: 2023 Jul 04 (Print Publication: 2023).
Publication Year :
2023

Abstract

In the title compound, C <subscript>38</subscript> H <subscript>28</subscript> O <subscript>6</subscript> , the dihedral angles between the naphthalene ring system and its pendant benz-yloxy rings A and B are 88.05 (7) and 80.84 (7)°, respectively. The dihedral angles between the A and B rings and their attached phenyl rings are 49.15 (8) and 80.78 (8)°, respectively. In the extended structure, the mol-ecules are linked by weak C-H⋯O and C-H⋯π hydrogen bonds, and π-π stacking inter-actions, which variously generate C (11) chains and R <subscript>2</subscript> <superscript>2</superscript> (12) loops as part of a three-dimensional network. The Hirshfeld surface [fingerprint contributions = H⋯H (42.3%), C⋯H/H⋯C (40.3%) and O⋯H/H⋯O (15.7%)] and inter-molecular inter-action energies are reported, with dispersion ( E <subscript>dis</subscript> = -428.6 kJ mol <superscript>-1</superscript> ) being the major contributor.<br /> (© Anil Kumar et al. 2023.)

Details

Language :
English
ISSN :
2056-9890
Volume :
79
Issue :
Pt 8
Database :
MEDLINE
Journal :
Acta crystallographica. Section E, Crystallographic communications
Publication Type :
Academic Journal
Accession number :
37601398
Full Text :
https://doi.org/10.1107/S2056989023005571