Analytical, Spectroscopic and Crystallographic Characterization of 3-[(2E)-3-Phenylprop-2-en-1-ylidene]pentane-2,4-dione

The structure of 3-[(2E)-3-phenylprop-2-en-1-ylidene]pentane-2,4-dione was determine by X-ray crystallography. The crystallographic data analysis reveals that the title compound crystallizes in monoclinic system and space group P21/a with the cell parameters a = 12.7006(4)Å, b = 10.0271(5)Å, c = 20....

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Bibliographic Details
Published inX-ray Structure Analysis Online Vol. 36; pp. 15 - 16
Main Authors RESENDE, Pamela C. S., COURI, Mara R. C., MIGUEL, Fábio B., CUIN, Alexandre
Format Journal Article
LanguageEnglish
Published The Japan Society for Analytical Chemistry 10.05.2020
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Summary:The structure of 3-[(2E)-3-phenylprop-2-en-1-ylidene]pentane-2,4-dione was determine by X-ray crystallography. The crystallographic data analysis reveals that the title compound crystallizes in monoclinic system and space group P21/a with the cell parameters a = 12.7006(4)Å, b = 10.0271(5)Å, c = 20.1044(10) and β = 106.525(3)°. The crystal structure was solved by direct methods and refined by full-matrix least-squares on F2 to final values of R1 = 0.083 and wR2 = 0.257. Some spectroscopic data were also reported.
ISSN:1883-3578
1883-3578
DOI:10.2116/xraystruct.36.15