Hirshfeld surface analysis and crystal structure of 7-methoxy-5-methyl-2-phenyl-11,12-dihydro-5,11-methano-1,2,4-triazolo[1,5-c][1,3,5]benzoxadiazocine
Yükleniyor...
Dosyalar
Tarih
2018
Dergi Başlığı
Dergi ISSN
Cilt Başlığı
Yayıncı
Int Union Crystallography
Erişim Hakkı
info:eu-repo/semantics/openAccess
Özet
The title compound, C19H18N4O2, crystallizes with two independent moleculesin the asymmetric unit. The triazole ring is inclined to the benzene rings by9.63 (13) and 87.37 (12) in one molecule, and by 4.46 (13) and 86.15 (11) in theother. In the crystal, classical N—H N hydrogen bonds, weak C—H Ohydrogen bonds and weak C—H interactions link the molecules into athree-dimensional supramolecular network. Hirshfeld surface analysis and two-dimensional fingerprint plots were used to investigate the intermolecularinteractions present in the crystal, indicating that the most importantcontributions for the crystal packing are from H H (51.4%), H C/C H(26.7%), H O/O H (8.9%) and H N/N H (8%) interactions.
Açıklama
Ondokuz Mayis University: F.279
Anahtar Kelimeler
Crystal structure, Biginelli condensa-tion, Benzoxadiazocine, Hirshfeld surface
Kaynak
Acta Crystallographica Section E-Crystallographic Communications
WoS Q Değeri
N/A
Scopus Q Değeri
N/A
Cilt
74
Sayı
Künye
Gümüş M. K., Kansız, S., Dege, N., & Kalibabchuk, V. A. (2018). Hirshfeld surface analysis and crystal structure of 7-methoxy-5-methyl-2-phenyl-11, 12-dihydro-5, 11-methano-1, 2, 4-triazolo [1, 5-c][1, 3, 5] benzoxadiazocine. Acta Crystallographica Section E: Crystallographic Communications, 74(9), 1211-1214.
