Publication:
Hirshfeld Surface Analysis and Crystal Structure of 7-Methoxy

Simple item page
dc.authorscopusid57213972060
dc.authorscopusid57194716371
dc.authorscopusid57201620841
dc.authorscopusid8897642900
dc.contributor.authorGümüş, M.K.
dc.contributor.authorKansız, S.
dc.contributor.authorDege, N.
dc.contributor.authorKalibabchuk, V.A.
dc.date.accessioned2020-06-21T13:07:17Z
dc.date.available2020-06-21T13:07:17Z
dc.date.issued2018
dc.departmentOndokuz Mayıs Üniversitesien_US
dc.department-temp[Gümüş] Mustafa Kemal, Science-Technology Research and Application Center, Artvin Coruh University, Artvin, Artvin, Turkey; [Kansız] Sevgi, Department of Physics, Ondokuz Mayis Üniversitesi, Samsun, Turkey; [Dege] Necmi, Department of Physics, Ondokuz Mayis Üniversitesi, Samsun, Turkey; [Kalibabchuk] Valentina A., Department of General Chemistry, Bogomolets National Medical University, Kyiv, Ukraineen_US
dc.description.abstractThe title compound, C<inf>19</inf> H<inf>18</inf> N<inf>4</inf> O<inf>2</inf>, crystallizes with two independent molecules in the asymmetric unit. The triazole ring is inclined to the benzene rings by 9.63 (13) and 87.37 (12)° in one molecule, and by 4.46 (13) and 86.15 (11)° in the other. In the crystal, classical N-H..N hydrogen bonds, weak C-H..O hydrogen bonds and weak C-H..π interactions link the molecules into a three-dimensional supramolecular network. Hirshfeld surface analysis and two-dimensional fingerprint plots were used to investigate the intermolecular interactions present in the crystal, indicating that the most important contributions 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. © 2018 Gumus et al.en_US
dc.identifier.doi10.1107/S2056989018010848
dc.identifier.endpage1214en_US
dc.identifier.issn2056-9890
dc.identifier.pmid30225101
dc.identifier.scopus2-s2.0-85053059106
dc.identifier.scopusqualityQ3
dc.identifier.startpage1211en_US
dc.identifier.urihttps://doi.org/10.1107/S2056989018010848
dc.identifier.volume74en_US
dc.identifier.wosWOS:000443407400006
dc.language.isoenen_US
dc.publisherInternational Union of Crystallography 5 Abbey Square Chester CH1 2HUen_US
dc.relation.ispartofActa Crystallographica Section E-Crystallographic Communicationsen_US
dc.relation.journalActa Crystallographica Section E-Crystallographic Communicationsen_US
dc.relation.publicationcategoryMakale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanıen_US
dc.rightsinfo:eu-repo/semantics/openAccessen_US
dc.subjectBenzoxadiazocineen_US
dc.subjectBiginelli Condensationen_US
dc.subjectCrystal Structureen_US
dc.subjectHirshfeld Surfaceen_US
dc.titleHirshfeld Surface Analysis and Crystal Structure of 7-Methoxyen_US
dc.typeArticleen_US
dspace.entity.typePublication

Files

Collections

Scopus İndeksli Yayınlar Koleksiyonu
PubMed İndeksli Yayınlar Koleksiyonu
WoS İndeksli Yayınlar Koleksiyonu