thiazoline-2-thione and tetracyanoethylene

thiazoline-2-thione has been researched along with tetracyanoethylene* in 1 studies

Other Studies

1 other study(ies) available for thiazoline-2-thione and tetracyanoethylene

Article	Year
Halogen vs hydrogen bonding in thiazoline-2-thione stabilization with σ- and π-electron acceptors adducts: theoretical and experimental study. Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 2015, Feb-25, Volume: 137 Molecular charge-transfer complexes (CT) between thiazoline-2-thione (THZ) and different σ- (I2) and π-acceptors (Tetracyanoethylene (TCNE), 2,3-dichloro-5,6-dicyano-1,4-benzoquinone (DDQ), and 2,3,5,6-tetrachloro-1,4-benzoquinone (CHL)) were investigated. UV-Vis absorption spectroscopy and theoretical calculations using both MP2/aug-cc-pVDZ-PP and B3LYP/6-311++G(d,p) level of theory were corroborated to study the nature of the stabilizing forces for THZ-I2, THZ-DDQ, THZ-TCNE, and THZ-CHL. Halogen bonding (XB) was the stabilizing attractive force in THZ-I2 and THZ-CHL whereas; hydrogen bonding (HB) was dominated in both THZ-TCNE, and THZ-DDQ complexes. Formation constant (K), extinction coefficient (ɛ), thermodynamic parameters such as enthalpy change (ΔH), entropy (ΔS), and Gibbs free energy (ΔG) were measured in different solvents. Topics: Benzoquinones; Chloranil; Electrons; Ethylenes; Halogens; Hydrogen Bonding; Models, Chemical; Models, Molecular; Molecular Structure; Nitriles; Solvents; Spectrophotometry, Ultraviolet; Thermodynamics; Thiazolidines	2015

Article

Year

Halogen vs hydrogen bonding in thiazoline-2-thione stabilization with σ- and π-electron acceptors adducts: theoretical and experimental study.

Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 2015, Feb-25, Volume: 137

Molecular charge-transfer complexes (CT) between thiazoline-2-thione (THZ) and different σ- (I2) and π-acceptors (Tetracyanoethylene (TCNE), 2,3-dichloro-5,6-dicyano-1,4-benzoquinone (DDQ), and 2,3,5,6-tetrachloro-1,4-benzoquinone (CHL)) were investigated. UV-Vis absorption spectroscopy and theoretical calculations using both MP2/aug-cc-pVDZ-PP and B3LYP/6-311++G(d,p) level of theory were corroborated to study the nature of the stabilizing forces for THZ-I2, THZ-DDQ, THZ-TCNE, and THZ-CHL. Halogen bonding (XB) was the stabilizing attractive force in THZ-I2 and THZ-CHL whereas; hydrogen bonding (HB) was dominated in both THZ-TCNE, and THZ-DDQ complexes. Formation constant (K), extinction coefficient (ɛ), thermodynamic parameters such as enthalpy change (ΔH), entropy (ΔS), and Gibbs free energy (ΔG) were measured in different solvents.

Topics: Benzoquinones; Chloranil; Electrons; Ethylenes; Halogens; Hydrogen Bonding; Models, Chemical; Models, Molecular; Molecular Structure; Nitriles; Solvents; Spectrophotometry, Ultraviolet; Thermodynamics; Thiazolidines

2015