A detailed DFT/TDDFT study on excited-state intramolecular hydrogen bonding dynamics and proton-transfer mechanism of 2-phenanthro[9,10-d]oxazol-2-yl-phenol

2018 ◽  
Vol 31 (10) ◽  
pp. e3857 ◽  
Author(s):  
Tianjie Zhang ◽  
Guang Yang ◽  
Min Jia ◽  
Xiaoyan Song ◽  
Qiaoli Zhang ◽  
...  
Keyword(s):  
Hydrogen Bonding ◽  
Excited State ◽  
Proton Transfer ◽  
Intramolecular Hydrogen Bonding ◽  
Transfer Mechanism ◽  
Intramolecular Hydrogen ◽  
Hydrogen Bonding Dynamics

scholarly journals Investigation of the intramolecular hydrogen bonding interactions and excited state proton transfer mechanism for both Br-BTN and CN-BTN systems

RSC Advances ◽  
2019 ◽  
Vol 9 (40) ◽  
pp. 23004-23011 ◽  
Author(s):  
Dapeng Yang ◽  
Qiaoli Zhang ◽  
Xiaoyan Song ◽  
Tianjie Zhang
Keyword(s):  
Hydrogen Bonding ◽  
Excited State ◽  
Proton Transfer ◽  
Intramolecular Hydrogen Bonding ◽  
Transfer Mechanism ◽  
Hydrogen Bonding Interactions ◽  
Excited State Proton Transfer ◽  
Intramolecular Hydrogen

In the present work, two novel Br-BTN and CN-BTN compounds have been investigated theoretically.

A detailed theoretical study on the excited-state hydrogen-bonding dynamics and the proton transfer mechanism for a novel white-light fluorophore

2018 ◽  
Vol 66 (1) ◽  
pp. 56-61 ◽  
Author(s):  
Haiyan Gao ◽  
Guang Yang ◽  
Min Jia ◽  
Xiaoyan Song ◽  
Qiaoli Zhang ◽  
...  
Keyword(s):  
Hydrogen Bonding ◽  
Excited State ◽  
Proton Transfer ◽  
White Light ◽  
Theoretical Study ◽  
Transfer Mechanism ◽  
Hydrogen Bonding Dynamics

Acid‐Induced Shift of Intramolecular Hydrogen Bonding Responsible for Excited‐State Intramolecular Proton Transfer

2018 ◽  
Vol 13 (13) ◽  
pp. 1735-1743 ◽  
Author(s):  
Qin Wang ◽  
Yahui Niu ◽  
Rong Wang ◽  
Haoran Wu ◽  
Yanrong Zhang
Keyword(s):  
Hydrogen Bonding ◽  
Excited State ◽  
Proton Transfer ◽  
Intramolecular Hydrogen Bonding ◽  
Intramolecular Proton Transfer ◽  
Intramolecular Hydrogen

Competitive intramolecular hydrogen bonding formation and excited-state proton transfer reaction in 1-[(diethylamino)-methyl]-2-hydroxy-3-naphthaldehyde

2004 ◽  
Vol 384 (4-6) ◽  
pp. 203-209 ◽  
Author(s):  
Kun-Chan Wu ◽  
Yi-Ming Cheng ◽  
Yu-Shan Lin ◽  
Yu-Shan Yeh ◽  
Shih-Chieh Pu ◽  
...  
Keyword(s):  
Hydrogen Bonding ◽  
Excited State ◽  
Proton Transfer ◽  
Transfer Reaction ◽  
Intramolecular Hydrogen Bonding ◽  
Proton Transfer Reaction ◽  
Excited State Proton Transfer ◽  
Intramolecular Hydrogen
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