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机构地区:[1]Key Laboratory for the Chemistry and Molecular Engineering of Medicinal Resources(Ministry of Education of China),School of Chemistry & Chemical Engineering of Guangxi Normal University [2]College of Chemistry and Chemical Engineering,Suzhou University
出 处:《Chinese Journal of Structural Chemistry》2010年第9期1327-1330,共4页结构化学(英文)
基 金:supported by the National Natural Science Foundation of China (No.30460153);the Project of Ten,Hundred,Thousand Distinguished Talents in New Century of Guangxi (No.2007228);the open fund of Key Laboratory of Development & Application of Forest Chemicals of Guangxi (GXFC08-05);Innovation Project of Guangxi Graduate Education (No.2009106020703M47)
摘 要:A novel lactone derived from dehydroabietic acid,C20H21BrO4,has been charac-terized by IR,1H NMR,13C NMR and single-crystal X-ray diffraction method.It crystallizes in orthorhombic,space group P212121 with a = 6.4195(15),b = 11.535(3),c = 24.654(6) ,V = 1825.5(7) 3,Z = 4,Mr = 405.28,Dc = 1.475 g/cm3,λ = 0.71075 ,μ(MoKα) = 2.27 mm-1,F(000) = 832,the final R = 0.024 and wR = 0.045 for 2152 observed reflections with I 2σ(I).The molecules of lactone are mainly linked through intermolecular hydrogen bonds.A novel lactone derived from dehydroabietic acid,C20H21BrO4,has been charac-terized by IR,1H NMR,13C NMR and single-crystal X-ray diffraction method.It crystallizes in orthorhombic,space group P212121 with a = 6.4195(15),b = 11.535(3),c = 24.654(6) ,V = 1825.5(7) 3,Z = 4,Mr = 405.28,Dc = 1.475 g/cm3,λ = 0.71075 ,μ(MoKα) = 2.27 mm-1,F(000) = 832,the final R = 0.024 and wR = 0.045 for 2152 observed reflections with I 2σ(I).The molecules of lactone are mainly linked through intermolecular hydrogen bonds.
关 键 词:novel lactone dehydroabietic acid SYNTHESIS crystal structure
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