{"title":"邻苯二甲酸[phth =邻苯二甲酸酯]水合物配合物的晶体结构","authors":"Jimin Xie, Wu Wen, Ya-wen Xuan","doi":"10.2116/ANALSCIX.24.X95","DOIUrl":null,"url":null,"abstract":"In an attempt to grow crystals of sodium acid phthalate, the title compound, (phth)2(H2O)3 (1) [phth=phthalate], was obtained which crystallizes in the monoclinic system; space group C2/c, β = 113.65(3)°, V = 1812.9(6)A3, Z = 4, Dc = 1.415 g/cm3, the final R = 0.0781 and wR = 0.2367. O-H groups of phthalate rings form strong hydrogen bonds with lattice water which stabilizes the crystal structure.","PeriodicalId":7796,"journal":{"name":"Analytical Sciences: X-ray Structure Analysis Online","volume":"10059 1","pages":""},"PeriodicalIF":0.0000,"publicationDate":"2008-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"4","resultStr":"{\"title\":\"Crystal Structure of a Hydrate Complex of Phthalic Acid [phth = o-phthalate]\",\"authors\":\"Jimin Xie, Wu Wen, Ya-wen Xuan\",\"doi\":\"10.2116/ANALSCIX.24.X95\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"In an attempt to grow crystals of sodium acid phthalate, the title compound, (phth)2(H2O)3 (1) [phth=phthalate], was obtained which crystallizes in the monoclinic system; space group C2/c, β = 113.65(3)°, V = 1812.9(6)A3, Z = 4, Dc = 1.415 g/cm3, the final R = 0.0781 and wR = 0.2367. O-H groups of phthalate rings form strong hydrogen bonds with lattice water which stabilizes the crystal structure.\",\"PeriodicalId\":7796,\"journal\":{\"name\":\"Analytical Sciences: X-ray Structure Analysis Online\",\"volume\":\"10059 1\",\"pages\":\"\"},\"PeriodicalIF\":0.0000,\"publicationDate\":\"2008-01-01\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"4\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Analytical Sciences: X-ray Structure Analysis Online\",\"FirstCategoryId\":\"1085\",\"ListUrlMain\":\"https://doi.org/10.2116/ANALSCIX.24.X95\",\"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.X95","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"","JCRName":"","Score":null,"Total":0}
引用次数: 4
摘要
在生长邻苯二甲酸钠晶体的尝试中，获得了标题化合物(phth)2(H2O)3 (1) [phth=邻苯二甲酸盐]，它在单斜体系中结晶;空间群C2/c， β = 113.65(3)°，V = 1812.9(6)A3, Z = 4, Dc = 1.415 g/cm3，最终R = 0.0781, wR = 0.2367。邻苯二甲酸酯环的O-H基团与晶格水形成强氢键，稳定了晶体结构。
Crystal Structure of a Hydrate Complex of Phthalic Acid [phth = o-phthalate]
In an attempt to grow crystals of sodium acid phthalate, the title compound, (phth)2(H2O)3 (1) [phth=phthalate], was obtained which crystallizes in the monoclinic system; space group C2/c, β = 113.65(3)°, V = 1812.9(6)A3, Z = 4, Dc = 1.415 g/cm3, the final R = 0.0781 and wR = 0.2367. O-H groups of phthalate rings form strong hydrogen bonds with lattice water which stabilizes the crystal structure.
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