A. Ebrahimi, M. Habibi-Khorassani, F. B. Akher, Abdolkarim Farrokhzadeh
{"title":"The N⋯HF Interactions in the X-Pyridazine⋯ (HF) Complexes: Substituent Effects and Energy Components","authors":"A. Ebrahimi, M. Habibi-Khorassani, F. B. Akher, Abdolkarim Farrokhzadeh","doi":"10.1155/2012/362608","DOIUrl":null,"url":null,"abstract":"The effects of substituents on the N⋯HF interactions in the X-pyridazine⋯(HF)𝑛 (X = N(CH3)2, NHCH3, NH2, C2H5, CH3, OCH3, OH, CN, OF, NO2, F, Br, Cl, and 𝑛=1,2) complexes have been studied at the B3LYP/6-311","PeriodicalId":7371,"journal":{"name":"Advances in Physical Chemistry","volume":null,"pages":null},"PeriodicalIF":0.0000,"publicationDate":"2012-04-09","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"2","resultStr":null,"platform":"Semanticscholar","paperid":null,"PeriodicalName":"Advances in Physical Chemistry","FirstCategoryId":"1085","ListUrlMain":"https://doi.org/10.1155/2012/362608","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"","JCRName":"","Score":null,"Total":0}
引用次数: 2
Abstract
The effects of substituents on the N⋯HF interactions in the X-pyridazine⋯(HF)𝑛 (X = N(CH3)2, NHCH3, NH2, C2H5, CH3, OCH3, OH, CN, OF, NO2, F, Br, Cl, and 𝑛=1,2) complexes have been studied at the B3LYP/6-311