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84896784713
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Some Of The 36-linked Oligomers Were Reported In A patent: CN 101205227 A 20080625
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Some of the 3,6-linked oligomers were reported in a patent: Qiu, Y.; Li, Y.; Dong, H.; Wang, C. CN 101205227 A 20080625, 2008
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84896748317
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(Tsinghua Univ. Beijing Visionox Technology Co. Ltd. Kunshan Visionox Company)
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(Tsinghua Univ., Beijing Visionox Technology Co., Ltd., Kunshan Visionox Company) .
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84896742685
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In contrast to the previously reported thienylcarbazole systems,8a the rotational disorder for the thiophene units is not observed in 6
-
In contrast to the previously reported thienylcarbazole systems,8a the rotational disorder for the thiophene units is not observed in 6.
-
-
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48
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70450206724
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All calculations were carried out using revision B.01; Gaussian, Inc.: Wallingford, CT
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All calculations were carried out using: Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Scuseria, G. E.; Robb, M. A.; Cheeseman, J. R.; Scalmani, G.; Barone, V.; Mennucci, B.; Petersson, G. A.; Nakatsuji, H.; Caricato, M.; Li, X.; Hratchian, H. P.; Izmaylov, A. F.; Bloino, J.; Zheng, G.; Sonnenberg, J. L.; Hada, M.; Ehara, M.; Toyota, K.; Fukuda, R.; Hasegawa, J.; Ishida, M.; Nakajima, T.; Honda, Y.; Kitao, O.; Nakai, H.; Vreven, T.; Montgomery, Jr., J. A.; Peralta, J. E.; Ogliaro, F.; Bearpark, M.; Heyd, J. J.; Brothers, E.; Kudin, K. N.; Staroverov, V. N.; Keith, T.; Kobayashi, R.; Normand, J.; Raghavachari, K.; Rendell, A.; Burant, J. C.; Iyengar, S. S.; Tomasi, J.; Cossi, M.; Rega, N.; Millam, J. M.; Klene, M.; Knox, J. E.; Cross, J. B.; Bakken, V.; Adamo, C.; Jaramillo, J.; Gomperts, R.; Stratmann, R. E.; Yazyev, O.; Austin, A. J.; Cammi, R.; Pomelli, C.; Ochterski, J. W.; Martin, R. L.; Morokuma, K.; Zakrzewski, V. G.; Voth, G. A.; Salvador, P.; Dannenberg, J. J.; Dapprich, S.; Daniels, A. D.; Farkas, O.; Foresman, J. B.; Ortiz, J. V.; Cioslowski, J.; Fox, D. J. Gaussian 09, revision B.01; Gaussian, Inc.: Wallingford, CT, 2010.
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Daniels, A.69
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Foresman, J.71
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more..
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49
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84896800555
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For details in the structural optimization, see Figure S2 in the Supporting Information
-
For details in the structural optimization, see Figure S2 in the Supporting Information.
-
-
-
-
50
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84896789695
-
-
We cannot entirely rule out the possibility that the DFT calculations underestimate the planarity of 6, because we examined only the B3LYP method for the calculations
-
We cannot entirely rule out the possibility that the DFT calculations underestimate the planarity of 6, because we examined only the B3LYP method for the calculations.
-
-
-
-
51
-
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0242301194
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-
For the effective conjugation length of 3,6-functionalized carbazole derivatives, see
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For the effective conjugation length of 3,6-functionalized carbazole derivatives, see: (a) Paliulis, O.; Ostrauskaite, J.; Gaidelis, V.; Jankauskas, V.; Strohriegl, P. Macromol. Chem. Phys. 2003, 204, 1706.
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53
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84896761456
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-
No characteristic excimer fluorescence was observed. The interpretation of the fluorescence spectra was kindly proposed by one of the referees
-
No characteristic excimer fluorescence was observed. The interpretation of the fluorescence spectra was kindly proposed by one of the referees.
-
-
-
-
54
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84896790049
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-
The emission decay profiles were numerically fitted by single exponential kinetics
-
The emission decay profiles were numerically fitted by single exponential kinetics.
-
-
-
-
56
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0029322623
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Pommerehne, J.; Vestweber, H.; Guss, W.; Mahrt, R. F.; Bassler, H.; Porsch, M.; Daub, J. Adv. Mater. 1995, 7, 551.
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Daub, J.7
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57
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84896798308
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The quinoidal thiophene structure should contribute to the remarkably high electrochemical stability of the cationic species of 4
-
The quinoidal thiophene structure should contribute to the remarkably high electrochemical stability of the cationic species of 4.
-
-
-
-
58
-
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84896749310
-
-
We note that the optimized structures are strongly affected by the initial structures in general. We did not perform the conformation search for 1′-10′
-
We note that the optimized structures are strongly affected by the initial structures in general. We did not perform the conformation search for 1′-10′.
-
-
-
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59
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84896797448
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The oscillator strength for the HOMO-LUMO transition of 2′ is calculated to be only 0.006 at 341 nm, and the configuration interaction coefficient is 90%
-
The oscillator strength for the HOMO-LUMO transition of 2′ is calculated to be only 0.006 at 341 nm, and the configuration interaction coefficient is 90%.
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