{"title":"六亚甲基氨基环三磷酸氮，N3P3(NMe2)6的质子化与BH3络合的量子研究","authors":"Jean-Paul Faucher, Jean-François Labarre","doi":"10.1016/0001-8716(76)80037-5","DOIUrl":null,"url":null,"abstract":"<div><p>The effects of protonation and of BH<sub>3</sub> complexation on the highly basic cyclophosphazene N<sub>3</sub>P<sub>3</sub>(NMe<sub>2</sub>)<sub>6</sub> are investigated within the framework of the CNDO/2 approximation. A noticeable diminution of the electronic density occurs into (PNP) Dewar islands supporting experimental evidence provided by X-ray diffraction and the Faraday effect.</p></div>","PeriodicalId":100050,"journal":{"name":"Advances in Molecular Relaxation Processes","volume":"8 3","pages":"Pages 169-175"},"PeriodicalIF":0.0000,"publicationDate":"1976-07-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://sci-hub-pdf.com/10.1016/0001-8716(76)80037-5","citationCount":"5","resultStr":"{\"title\":\"Étude quantique comparée de la protonation et de la complexation par BH3 de l'hexadiméthylaminocyclo-triphosphazène, N3P3(NMe2)6\",\"authors\":\"Jean-Paul Faucher, Jean-François Labarre\",\"doi\":\"10.1016/0001-8716(76)80037-5\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<div><p>The effects of protonation and of BH<sub>3</sub> complexation on the highly basic cyclophosphazene N<sub>3</sub>P<sub>3</sub>(NMe<sub>2</sub>)<sub>6</sub> are investigated within the framework of the CNDO/2 approximation. A noticeable diminution of the electronic density occurs into (PNP) Dewar islands supporting experimental evidence provided by X-ray diffraction and the Faraday effect.</p></div>\",\"PeriodicalId\":100050,\"journal\":{\"name\":\"Advances in Molecular Relaxation Processes\",\"volume\":\"8 3\",\"pages\":\"Pages 169-175\"},\"PeriodicalIF\":0.0000,\"publicationDate\":\"1976-07-01\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"https://sci-hub-pdf.com/10.1016/0001-8716(76)80037-5\",\"citationCount\":\"5\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Advances in Molecular Relaxation Processes\",\"FirstCategoryId\":\"1085\",\"ListUrlMain\":\"https://www.sciencedirect.com/science/article/pii/0001871676800375\",\"RegionNum\":0,\"RegionCategory\":null,\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"\",\"JCRName\":\"\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Advances in Molecular Relaxation Processes","FirstCategoryId":"1085","ListUrlMain":"https://www.sciencedirect.com/science/article/pii/0001871676800375","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"","JCRName":"","Score":null,"Total":0}
Étude quantique comparée de la protonation et de la complexation par BH3 de l'hexadiméthylaminocyclo-triphosphazène, N3P3(NMe2)6
The effects of protonation and of BH3 complexation on the highly basic cyclophosphazene N3P3(NMe2)6 are investigated within the framework of the CNDO/2 approximation. A noticeable diminution of the electronic density occurs into (PNP) Dewar islands supporting experimental evidence provided by X-ray diffraction and the Faraday effect.
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