{"title":"根据气相色谱保留指数数据计算线性C7-C14炔的Abraham模型l -描述符和标准摩尔蒸发焓","authors":"N. Shanmugam, Shrika Eddula, W. Acree, M. Abraham","doi":"10.17628/ecb.2021.10.46-57","DOIUrl":null,"url":null,"abstract":"Abraham model L solute descriptors have been determined for an additional 33 linear C 7 -C 14 alkynes based on published gas chromatographic retention indices for solutes eluted from capillary columns coated with squalane and apiezon L stationary phases. Standard molar enthalpies of vaporization and sublimation at 298 K are calculated for the 33 linear alkynes using the reported solute descriptors and our recently published Abraham model correlations. Calculated vaporization enthalpies derived from the Abraham model compare very favourably with values based on a popular atom-group additivity model.","PeriodicalId":11880,"journal":{"name":"European Chemical Bulletin","volume":"1 1","pages":""},"PeriodicalIF":0.0000,"publicationDate":"2021-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"3","resultStr":"{\"title\":\"Calculation of Abraham model L-descriptor and standard molar enthalpies of vaporization for linear C7-C14 alkynes from gas chromatographic retention index data\",\"authors\":\"N. Shanmugam, Shrika Eddula, W. Acree, M. Abraham\",\"doi\":\"10.17628/ecb.2021.10.46-57\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"Abraham model L solute descriptors have been determined for an additional 33 linear C 7 -C 14 alkynes based on published gas chromatographic retention indices for solutes eluted from capillary columns coated with squalane and apiezon L stationary phases. Standard molar enthalpies of vaporization and sublimation at 298 K are calculated for the 33 linear alkynes using the reported solute descriptors and our recently published Abraham model correlations. Calculated vaporization enthalpies derived from the Abraham model compare very favourably with values based on a popular atom-group additivity model.\",\"PeriodicalId\":11880,\"journal\":{\"name\":\"European Chemical Bulletin\",\"volume\":\"1 1\",\"pages\":\"\"},\"PeriodicalIF\":0.0000,\"publicationDate\":\"2021-01-01\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"3\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"European Chemical Bulletin\",\"FirstCategoryId\":\"1085\",\"ListUrlMain\":\"https://doi.org/10.17628/ecb.2021.10.46-57\",\"RegionNum\":0,\"RegionCategory\":null,\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q3\",\"JCRName\":\"Chemistry\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"European Chemical Bulletin","FirstCategoryId":"1085","ListUrlMain":"https://doi.org/10.17628/ecb.2021.10.46-57","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q3","JCRName":"Chemistry","Score":null,"Total":0}
Calculation of Abraham model L-descriptor and standard molar enthalpies of vaporization for linear C7-C14 alkynes from gas chromatographic retention index data
Abraham model L solute descriptors have been determined for an additional 33 linear C 7 -C 14 alkynes based on published gas chromatographic retention indices for solutes eluted from capillary columns coated with squalane and apiezon L stationary phases. Standard molar enthalpies of vaporization and sublimation at 298 K are calculated for the 33 linear alkynes using the reported solute descriptors and our recently published Abraham model correlations. Calculated vaporization enthalpies derived from the Abraham model compare very favourably with values based on a popular atom-group additivity model.