Spiropyrans and spirooxazines 6. The spectral and kinetic properties of 5-(4,5-diphenyl-1,3-oxazol-2-yl)-substituted spironaphthopyrans: an experimental and theoretical study
被引:7
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作者:
Chernyshev, A. V.
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So Fed Univ, Inst Phys & Organ Chem, Rostov Na Donu 344090, RussiaSo Fed Univ, Inst Phys & Organ Chem, Rostov Na Donu 344090, Russia
Chernyshev, A. V.
[1
]
Dorogan, I. V.
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So Fed Univ, Inst Phys & Organ Chem, Rostov Na Donu 344090, RussiaSo Fed Univ, Inst Phys & Organ Chem, Rostov Na Donu 344090, Russia
Dorogan, I. V.
[1
]
Voloshin, N. A.
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Russian Acad Sci, So Res Ctr, Rostov Na Donu 344006, RussiaSo Fed Univ, Inst Phys & Organ Chem, Rostov Na Donu 344090, Russia
Voloshin, N. A.
[2
]
Metelitsa, A. V.
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So Fed Univ, Inst Phys & Organ Chem, Rostov Na Donu 344090, RussiaSo Fed Univ, Inst Phys & Organ Chem, Rostov Na Donu 344090, Russia
Metelitsa, A. V.
[1
]
Minkin, V. I.
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So Fed Univ, Inst Phys & Organ Chem, Rostov Na Donu 344090, RussiaSo Fed Univ, Inst Phys & Organ Chem, Rostov Na Donu 344090, Russia
Minkin, V. I.
[1
]
机构:
[1] So Fed Univ, Inst Phys & Organ Chem, Rostov Na Donu 344090, Russia
[2] Russian Acad Sci, So Res Ctr, Rostov Na Donu 344006, Russia
spiropyrans;
photochromism;
quantum chemical calculations;
density functional theory;
time-dependent density functional theory;
PBE0 and B3LYP functionals;
D O I:
10.1007/s11172-011-0072-4
中图分类号:
O6 [化学];
学科分类号:
0703 ;
摘要:
The spectral and kinetic properties of 5-(4,5-diphenyl-1,3-oxazol-2-yl)spiro[indoline-naphthopyran] derivatives were studied by experimental and theoretical methods. The additional long-wavelength maximum in the absorption spectra of compounds studied is due to the introduction of a diphenyloxazole fragment and corresponds to a pi-pi* electronic transition with a partial charge transfer character. Substituents have little effect on the kinetic parameters of the spironaphthopyrans studied.