Condensed-Phase Effects on the Structual Properties of C6H6CH2CN-SiF4 and CH3CH2CN-SiF4
File(s)
Date
2015-04Author
Hora, Nicholas J.
Advisor(s)
Phillips, James A.
Metadata
Show full item recordAbstract
Our research involves the identification of molecular complexes that change structure when the chemical environment is altered, e.g., gas-phase to solid-state. The plot conveys a general mechanism for bulk condensed-phase effects. The key is a long bond length in the gas phase with a very slight energy rise towards the shorter donor-acceptor distances. The addition of solvation energies can shift the bond length inward.
Subject
C6H5CH2CN-SiF4
CH3CN-SiF4
Molecular complexes
Posters
Permanent Link
http://digital.library.wisc.edu/1793/74452Description
Color poster with text, models, and graphs.