Computational studies of 2-(4-oxo-3-phenylthiazolidin-2-ylidene) malononitrile
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The molecular structure of the 2-(4-oxo-3-phenylthiazolidin-2-ylidene) malononitrile (3) is calculated using DFT B3LYP/6-311G(d, p) method. The calculated geometric parameters are in good agreement with the experimental data.
Nội dung trích xuất từ tài liệu:
Computational studies of 2-(4-oxo-3-phenylthiazolidin-2-ylidene) malononitrile
Nội dung trích xuất từ tài liệu:
Computational studies of 2-(4-oxo-3-phenylthiazolidin-2-ylidene) malononitrile
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