Theoretical and Experimental Investigation on Dipole Moment of Synthetized yt-Base in the Ground and Excited States
1979 ◽
Vol 34
(2)
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pp. 172-175
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Keyword(s):
Abstract The electric dipole moment of yt-Base calculated by the CNDO/S and JNDO/S method is μg = 3.42 D and μg = 3.74 D in the ground state and μe = 4.41 D and μe = 5.67 D in the first excited ππ*-state, respectively, μg and μe being nearly antiparallel. Measurements of absorption and fluorescence spectra of yt-Base in aprotic solvents of different polarity yielded μg = 3.8 D and μe = 4.3 D and the directions of dipole moments were found to be nearly antiparallel.This comparison may be considered as an indication for the ππ* character of the observable first excited state, although the CNDO/S-and JNDO/S-calculations predict a nπ*-state as the lowest lying excited state
2001 ◽
Vol 56
(5)
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pp. 407-411
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2000 ◽
Vol 55
(5)
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pp. 550-554
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2011 ◽
Vol 79
(5)
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pp. 1220-1225
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Keyword(s):
2008 ◽
Vol 69
(3)
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pp. 991-997
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Keyword(s):
2006 ◽
Vol 320
(2-3)
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pp. 188-192
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