STRUCTURAL STUDY OF A NEW 1-(2-THIENYL)-3-(3-METHYL-2-THIENYL)-PROPENONE, IN SITU RADIATION-INDUCED DIMERIZATION PRODUCTS
The new conjugated system ("chalcone kind") reported herein, 1-(2-thienyl)-3-(3-methyl-2-thienyl)-propenone, C12H10OS2 presents a monomeric molecular structure, and it most interesting aspects are to be found in it intermolecular interactions, of varied type (C-H-O, C-H---7C, n-n) and strength. Some anomalies detected in the refinement process, however, provided evidence that an unexpected in-situ, radiation-induced dimerization reaction had taken place during data collection, with the starting and final products coexisting in a topotactic fashion. This effect is depended of structural packing; that is not all this kind of conjugated system presents this effect. The main factor is the distance between the double bonds of neighboring monomers (about 3 A).
Main Authors: | , , , , |
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Format: | Digital revista |
Language: | English |
Published: |
Sociedad Chilena de Química
2010
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Online Access: | http://www.scielo.cl/scielo.php?script=sci_arttext&pid=S0717-97072010000400024 |
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Summary: | The new conjugated system ("chalcone kind") reported herein, 1-(2-thienyl)-3-(3-methyl-2-thienyl)-propenone, C12H10OS2 presents a monomeric molecular structure, and it most interesting aspects are to be found in it intermolecular interactions, of varied type (C-H-O, C-H---7C, n-n) and strength. Some anomalies detected in the refinement process, however, provided evidence that an unexpected in-situ, radiation-induced dimerization reaction had taken place during data collection, with the starting and final products coexisting in a topotactic fashion. This effect is depended of structural packing; that is not all this kind of conjugated system presents this effect. The main factor is the distance between the double bonds of neighboring monomers (about 3 A). |
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