@article{oai:nagoya.repo.nii.ac.jp:00029311, author = {Ogumi, Keisuke and Matsuo, Yutaka}, issue = {10}, journal = {Journal of Porphyrins and Phthalocyanines}, month = {Nov}, note = {To investigate the solubility of porphyrin derivatives, their intermolecular interaction energies were calculated by the counterpoise method at the B97D3/6-31G(d) level. It was found that the calculated intermolecular interaction energies corresponded to the solubility measured by UV-vis spectroscopy. This correlation was consistent with differences in substituents and in the metals in the porphyrin core., ファイル公開:2020/11/1}, pages = {1144--1148}, title = {Prediction of magnesium tetraethynylporphyrin’s solubility by theoretical calculation}, volume = {23}, year = {2019} }