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Crystal structure and Hirshfeld surface analysis of 2,2"′,6,6"′-tetramethoxy-3,2′:5′3":6",3"′-quater-pyridineopen access

Authors
Moon, Suk-HeeKim, JinhoPark, Ki-MinKang, Youngjin
Issue Date
Oct-2019
Publisher
INT UNION CRYSTALLOGRAPHY
Keywords
crystal structure; quaterpyridine derivative; pi-pi interaction; C-H center dot center dot center dot pi interaction; Hirshfeld surface analysis
Citation
ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS, v.75, pp 1511 - +
Indexed
SCOPUS
ESCI
Journal Title
ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS
Volume
75
Start Page
1511
End Page
+
URI
https://scholarworks.gnu.ac.kr/handle/sw.gnu/73322
DOI
10.1107/S205698901901274X
ISSN
2056-9890
Abstract
In the title compound, C24H22N4O4, the four pyridine rings are tilted slightly with respect to each other. The dihedral angles between the inner and outer pyridine rings are 12.51 (8) and 9.67 (9)degrees, while that between inner pyridine rings is 20.10 (7)degrees. Within the molecule, intramolecular C-H center dot center dot center dot O and C-H center dot center dot center dot N contacts are observed. In the crystal, adjacent molecules are linked by pi-pi stacking interactions between pyridine rings and weak C-H center dot center dot center dot pi interactions between a methyl H atom and the centroid of a pyridine ring, forming a two-dimensional layer structure extending parallel to the ac plane. Hirshfeld surface analysis and two-dimensional fingerprint plots indicate that the most important contributions to the crystal packing are from H center dot center dot center dot H (52.9%) and H center dot center dot center dot C/C center dot center dot center dot H (17.3%) contacts.
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