Matches in SemOpenAlex for { <https://semopenalex.org/work/W3193847368> ?p ?o ?g. }
- W3193847368 endingPage "106605" @default.
- W3193847368 startingPage "106605" @default.
- W3193847368 abstract "In this work, the equilibrium solubility and thermodynamic properties of N, N'-Diphenyl thiourea (DPTU) in twelve organic solvents were reported. The solubility of DPTU in twelve organic solvents was investigated by gravimetric method from 283.15 K to 323.15 K under atmospheric pressure. It was proved that the solubility of DPTU in twelve organic solvents is positively correlated with temperature. The results indicated the solubility of DPTU in pure solvents was well correlated by modified Apelblat equation, λh equation, Van't Hoff equation, and the NRTL model, which showed less than 8% average relative deviation (ARD) for all the four thermodynamic models. Furthermore, the thermodynamic properties of DPTU in selected solvents were analyzed by the NRTL model, which indicated that the mixing process of DPTU in organic solvents is spontaneous. In addition, the physicochemical properties of twelve organic solvents were investigated to determine the effect of solvent effects on solubility. The intermolecular forces were determined through molecular simulations, including Hirshfeld surface analysis (HS), Molecular Electrostatic Potential Surface (MEPs), and Radial distribution function (RDF) analysis. The results showed that hydrogen bond can be formed between DPTU and the selected solvents, which can help to further explain the dissolution behavior of DPTU in the solvents." @default.
- W3193847368 created "2021-08-30" @default.
- W3193847368 creator A5021541091 @default.
- W3193847368 creator A5041081754 @default.
- W3193847368 creator A5046187535 @default.
- W3193847368 creator A5049699421 @default.
- W3193847368 creator A5060114453 @default.
- W3193847368 creator A5076124418 @default.
- W3193847368 creator A5083924072 @default.
- W3193847368 date "2021-12-01" @default.
- W3193847368 modified "2023-09-27" @default.
- W3193847368 title "Solid-liquid phase equilibrium of N, N'-diphenyl thiourea (DPTU) in twelve pure solvents: Solubility determination, correlation, molecular simulation and thermodynamic analysis" @default.
- W3193847368 cites W1571461291 @default.
- W3193847368 cites W1967768823 @default.
- W3193847368 cites W1971721583 @default.
- W3193847368 cites W1973106190 @default.
- W3193847368 cites W1979787538 @default.
- W3193847368 cites W1990437495 @default.
- W3193847368 cites W1990782965 @default.
- W3193847368 cites W2003269597 @default.
- W3193847368 cites W2013176211 @default.
- W3193847368 cites W2014530204 @default.
- W3193847368 cites W2019079537 @default.
- W3193847368 cites W2019987110 @default.
- W3193847368 cites W2026785010 @default.
- W3193847368 cites W2027068424 @default.
- W3193847368 cites W2032935307 @default.
- W3193847368 cites W2071706211 @default.
- W3193847368 cites W2072476365 @default.
- W3193847368 cites W2075594220 @default.
- W3193847368 cites W2102989048 @default.
- W3193847368 cites W2127180098 @default.
- W3193847368 cites W2127435697 @default.
- W3193847368 cites W2132525235 @default.
- W3193847368 cites W2147304506 @default.
- W3193847368 cites W2161446221 @default.
- W3193847368 cites W2171250148 @default.
- W3193847368 cites W2235456616 @default.
- W3193847368 cites W2279503064 @default.
- W3193847368 cites W2280748522 @default.
- W3193847368 cites W2520406266 @default.
- W3193847368 cites W2608058506 @default.
- W3193847368 cites W2612638071 @default.
- W3193847368 cites W2794707563 @default.
- W3193847368 cites W2937233568 @default.
- W3193847368 cites W2980014860 @default.
- W3193847368 cites W2982082965 @default.
- W3193847368 cites W2996984063 @default.
- W3193847368 cites W3016816326 @default.
- W3193847368 cites W3023755168 @default.
- W3193847368 cites W3036186287 @default.
- W3193847368 cites W3086140963 @default.
- W3193847368 cites W3112290820 @default.
- W3193847368 doi "https://doi.org/10.1016/j.jct.2021.106605" @default.
- W3193847368 hasPublicationYear "2021" @default.
- W3193847368 type Work @default.
- W3193847368 sameAs 3193847368 @default.
- W3193847368 citedByCount "7" @default.
- W3193847368 countsByYear W31938473682022 @default.
- W3193847368 countsByYear W31938473682023 @default.
- W3193847368 crossrefType "journal-article" @default.
- W3193847368 hasAuthorship W3193847368A5021541091 @default.
- W3193847368 hasAuthorship W3193847368A5041081754 @default.
- W3193847368 hasAuthorship W3193847368A5046187535 @default.
- W3193847368 hasAuthorship W3193847368A5049699421 @default.
- W3193847368 hasAuthorship W3193847368A5060114453 @default.
- W3193847368 hasAuthorship W3193847368A5076124418 @default.
- W3193847368 hasAuthorship W3193847368A5083924072 @default.
- W3193847368 hasConcept C112887158 @default.
- W3193847368 hasConcept C121332964 @default.
- W3193847368 hasConcept C147789679 @default.
- W3193847368 hasConcept C155574463 @default.
- W3193847368 hasConcept C170961132 @default.
- W3193847368 hasConcept C178790620 @default.
- W3193847368 hasConcept C184651966 @default.
- W3193847368 hasConcept C185592680 @default.
- W3193847368 hasConcept C2780471494 @default.
- W3193847368 hasConcept C2780538656 @default.
- W3193847368 hasConcept C31057274 @default.
- W3193847368 hasConcept C32909587 @default.
- W3193847368 hasConcept C40117563 @default.
- W3193847368 hasConcept C44280652 @default.
- W3193847368 hasConcept C88380143 @default.
- W3193847368 hasConcept C96278889 @default.
- W3193847368 hasConcept C97355855 @default.
- W3193847368 hasConceptScore W3193847368C112887158 @default.
- W3193847368 hasConceptScore W3193847368C121332964 @default.
- W3193847368 hasConceptScore W3193847368C147789679 @default.
- W3193847368 hasConceptScore W3193847368C155574463 @default.
- W3193847368 hasConceptScore W3193847368C170961132 @default.
- W3193847368 hasConceptScore W3193847368C178790620 @default.
- W3193847368 hasConceptScore W3193847368C184651966 @default.
- W3193847368 hasConceptScore W3193847368C185592680 @default.
- W3193847368 hasConceptScore W3193847368C2780471494 @default.
- W3193847368 hasConceptScore W3193847368C2780538656 @default.
- W3193847368 hasConceptScore W3193847368C31057274 @default.
- W3193847368 hasConceptScore W3193847368C32909587 @default.
- W3193847368 hasConceptScore W3193847368C40117563 @default.