synthesis and ab initio study of pyrano[2,3-d]pyrimidine derivatives

نویسندگان

masoumeh shahi

naser foroughifar

shahram moradi

چکیده

tetrahydrobenzo[b]pyran derivatives 1 were utilized for the synthesis of several new pyrano[2,3-d]pyrimidine derivatives 2. compound 2 was obtained in the presence of ac2o/h2so4 (as a catalyst) and was confirmed by spectroscopic data such as ir, 1h nmr and 13c nmr. ab initio calculation was carried out to study geometric optimization, thermodynamic parameters, aromaticity and dynamic process of conformational analysis for compound 2.

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Synthesis and Ab Initio Study of Pyrano[2,3-d]pyrimidine Derivatives

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عنوان ژورنال:
iranian journal of chemistry and chemical engineering (ijcce)

ناشر: iranian institute of research and development in chemical industries (irdci)-acecr

ISSN 1021-9986

دوره 33

شماره 1 2014

کلمات کلیدی
[ ' p y r a n o [ 2 ' , 3 , ' d ] p y r i m i d i n e d e r i v a t i v e s ' , ' a b i n i t i o c a l c u l a t i o n ' , ' a r o m a t i c i t y ' , ' c o n f o r m a t i o n a l a n a l y s i s ' ]

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