{"title":"四氟硼酸铵的分子结构","authors":"H. Reinke, I. Schicht, A. Schulz, A. Villinger","doi":"10.2116/ANALSCIX.24.X307","DOIUrl":null,"url":null,"abstract":"The title compound, MesNH3+BF4-·(CH3CN) (1) (Mes = 2,4,6-trimethylphenyl), crystallizes in the triclinic space group P1 with a = 8.5468(4), b = 12.9136(7), c = 13.2661(7)A, α = 64.303(3)°, β = 74.452(2)°, γ = 73.177(2)°, V = 1245.54(11)A3, Z = 2. The crystal packing is stabilized by strong interionic N-H…F and N-H…N hydrogen bonds between anions and cations, resulting in a three-dimensional network structure. One of the two tetrafluoroborate anions is disordered [site occupation factors 0.811(2) and 0.189(2)].","PeriodicalId":7796,"journal":{"name":"Analytical Sciences: X-ray Structure Analysis Online","volume":"18 1","pages":""},"PeriodicalIF":0.0000,"publicationDate":"2008-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Molecular Structure of Mesitylammonium Tetrafluoroborate\",\"authors\":\"H. Reinke, I. Schicht, A. Schulz, A. Villinger\",\"doi\":\"10.2116/ANALSCIX.24.X307\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"The title compound, MesNH3+BF4-·(CH3CN) (1) (Mes = 2,4,6-trimethylphenyl), crystallizes in the triclinic space group P1 with a = 8.5468(4), b = 12.9136(7), c = 13.2661(7)A, α = 64.303(3)°, β = 74.452(2)°, γ = 73.177(2)°, V = 1245.54(11)A3, Z = 2. The crystal packing is stabilized by strong interionic N-H…F and N-H…N hydrogen bonds between anions and cations, resulting in a three-dimensional network structure. One of the two tetrafluoroborate anions is disordered [site occupation factors 0.811(2) and 0.189(2)].\",\"PeriodicalId\":7796,\"journal\":{\"name\":\"Analytical Sciences: X-ray Structure Analysis Online\",\"volume\":\"18 1\",\"pages\":\"\"},\"PeriodicalIF\":0.0000,\"publicationDate\":\"2008-01-01\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Analytical Sciences: X-ray Structure Analysis Online\",\"FirstCategoryId\":\"1085\",\"ListUrlMain\":\"https://doi.org/10.2116/ANALSCIX.24.X307\",\"RegionNum\":0,\"RegionCategory\":null,\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"\",\"JCRName\":\"\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Analytical Sciences: X-ray Structure Analysis Online","FirstCategoryId":"1085","ListUrlMain":"https://doi.org/10.2116/ANALSCIX.24.X307","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"","JCRName":"","Score":null,"Total":0}
引用次数: 0
摘要
标题化合物MesNH3+BF4-·(CH3CN) (1) (Mes = 2,4,6-三甲基苯基)在三斜空间群P1中结晶，a = 8.5468(4)， b = 12.9136(7)， c = 13.2661(7) a， α = 64.303(3)°，β = 74.452(2)°，γ = 73.177(2)°，V = 1245.54(11)A3, Z = 2。通过强离子间N- h…F和N- h…N氢键，使晶体填料稳定，形成三维网络结构。两个四氟硼酸盐阴离子中有一个是无序的[占位因子分别为0.811(2)和0.189(2)]。
Molecular Structure of Mesitylammonium Tetrafluoroborate
The title compound, MesNH3+BF4-·(CH3CN) (1) (Mes = 2,4,6-trimethylphenyl), crystallizes in the triclinic space group P1 with a = 8.5468(4), b = 12.9136(7), c = 13.2661(7)A, α = 64.303(3)°, β = 74.452(2)°, γ = 73.177(2)°, V = 1245.54(11)A3, Z = 2. The crystal packing is stabilized by strong interionic N-H…F and N-H…N hydrogen bonds between anions and cations, resulting in a three-dimensional network structure. One of the two tetrafluoroborate anions is disordered [site occupation factors 0.811(2) and 0.189(2)].
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