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Supporting information for Cross-conjugation controls the stabilities and photophysical properties of heteroazoarene photoswitches
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posted on 2021-10-15, 16:14
authored by
Daniel Adrion
Daniel Adrion
,
Steven Lopez
Steven Lopez
The optimized output files for the E and Z reactants, the Intrinsic Reaction Coordinate (IRC) calculations, and the transition state geometries of the four azoarenes presented in this study. All data here is present in zipped folder
Funding
NSF-OAC-2118201
NSF-OAC-1940307
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Categories
Computational chemistry
Physical organic chemistry
Theoretical quantum chemistry
Keywords
Physical organic chemistry
Computational Chemistry
Photoswitches
photophysics
Computational Chemistry
Physical Organic Chemistry
Quantum Chemistry
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CC BY 4.0
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