C - H center dot center dot center dot O and C - H center dot center dot center dot pi interactions in 1-acetyl-4-(p-chlorobenzylideneamino)-3-ethyl-4,5-dihydro-1H-1,2,4-triazol-5-one

CORUH, UĞUR; KAHVECI, B; Sasmaz, SELAMİ; AGAR, E; KIM, Y; ERDONMEZ, A

doi:10.1107/s010827010301326x

C - H center dot center dot center dot O and C - H center dot center dot center dot pi interactions in 1-acetyl-4-(p-chlorobenzylideneamino)-3-ethyl-4,5-dihydro-1H-1,2,4-triazol-5-one

CORUH U., KAHVECI B., Sasmaz S., AGAR E., KIM Y., ERDONMEZ A.

ACTA CRYSTALLOGRAPHICA SECTION C-CRYSTAL STRUCTURE COMMUNICATIONS, vol.59, 2003 (SCI-Expanded, Scopus)

Publication Type: Article / Article
Volume: 59
Publication Date: 2003
Doi Number: 10.1107/s010827010301326x
Journal Name: ACTA CRYSTALLOGRAPHICA SECTION C-CRYSTAL STRUCTURE COMMUNICATIONS
Journal Indexes: Science Citation Index Expanded (SCI-EXPANDED), Scopus
Recep Tayyip Erdoğan University Affiliated: Yes

Abstract

The title compound, C13H13ClN4O2, contains both a phenyl and a triazole ring, both of which are approximately coplanar with the entire molecule. The triazole ring has substituents at the 1-, 2- and 4-positions. Intramolecular C-H...O and C-H...N interactions, together with intermolecular C-H...O and C-H...pi interactions, help to stabilize the structure.