M. C. Lozada, R. Enríquez, B. Ortíz, M. Soriano-garcia
{"title":"Heterocyclic Derivatives of Curcumin: Crystal Structure of 3,5-Bis[β-(4-acetoxy-3-methoxyphenyl)ethyl]pyrazole Benzene Solvate","authors":"M. C. Lozada, R. Enríquez, B. Ortíz, M. Soriano-garcia","doi":"10.2116/ANALSCIX.24.X1","DOIUrl":null,"url":null,"abstract":"C25H28N2O6·0.50(C6H6) is monoclinic, C2/c. The unit-cell dimensions at 293 K are a = 13.968(2), b = 25.185(3), c = 15.050(2)A, β = 102.272(2)°, V = 5173.4(12)A3, Dx = 1.262 g/cm3, and Z = 8. The R value is R = 0.0766 for 1463 reflections. There is an intermolecular hydrogen bond with an N1…N1 distance of 2.851(7)A. The pyrazole ring adopts a distorted envelope conformation. The molecules in the crystal are packed at the normal van der Waals distances.","PeriodicalId":7796,"journal":{"name":"Analytical Sciences: X-ray Structure Analysis Online","volume":"3 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.X1","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"","JCRName":"","Score":null,"Total":0}
引用次数: 0
Abstract
C25H28N2O6·0.50(C6H6) is monoclinic, C2/c. The unit-cell dimensions at 293 K are a = 13.968(2), b = 25.185(3), c = 15.050(2)A, β = 102.272(2)°, V = 5173.4(12)A3, Dx = 1.262 g/cm3, and Z = 8. The R value is R = 0.0766 for 1463 reflections. There is an intermolecular hydrogen bond with an N1…N1 distance of 2.851(7)A. The pyrazole ring adopts a distorted envelope conformation. The molecules in the crystal are packed at the normal van der Waals distances.