Prediction of magnesium tetraethynylporphyrin’s solubility by theoretical calculation
2019 ◽
Vol 23
(10)
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pp. 1144-1148
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Keyword(s):
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.
2012 ◽
Vol 77
(2)
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pp. 187-199
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2015 ◽
Vol 119
(30)
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pp. 9477-9495
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Keyword(s):
2000 ◽
Vol 112
(16)
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pp. 6949-6952
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Keyword(s):
2008 ◽
Vol 10
(23)
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pp. 3400
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Keyword(s):
1999 ◽
Vol 20
(7)
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pp. 730-748
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Keyword(s):
2019 ◽
Vol 23
(2)
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pp. 239-248
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