FILIPOVÁ, Lenka, Miriam KOHAGEN, Peter ŠTACKO, Eva MUCHOVA, Petr SLAVÍČEK and Petr KLÁN. Photoswitching of Azobenzene-Based Reverse Micelles above and at Subzero Temperatures As Studied by NMR and Molecular Dynamics Simulations. Langmuir. WASHINGTON: AMER CHEMICAL SOC, 2017, vol. 33, No 9, p. 2306-2317. ISSN 0743-7463. Available from: https://dx.doi.org/10.1021/acs.langmuir.6b04455.
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Basic information
Original name Photoswitching of Azobenzene-Based Reverse Micelles above and at Subzero Temperatures As Studied by NMR and Molecular Dynamics Simulations
Authors FILIPOVÁ, Lenka (203 Czech Republic, belonging to the institution), Miriam KOHAGEN (276 Germany), Peter ŠTACKO (703 Slovakia, belonging to the institution), Eva MUCHOVA (203 Czech Republic), Petr SLAVÍČEK (203 Czech Republic) and Petr KLÁN (203 Czech Republic, guarantor, belonging to the institution).
Edition Langmuir, WASHINGTON, AMER CHEMICAL SOC, 2017, 0743-7463.
Other information
Original language English
Type of outcome Article in a journal
Field of Study 10401 Organic chemistry
Country of publisher United States of America
Confidentiality degree is not subject to a state or trade secret
WWW URL
Impact factor Impact factor: 3.789
RIV identification code RIV/00216224:14310/17:00095284
Organization unit Faculty of Science
Doi http://dx.doi.org/10.1021/acs.langmuir.6b04455
UT WoS 000395964100026
Keywords in English IONIC LIQUIDS; FORCE-FIELD; TRANS ISOMERIZATION; DRUG-DELIVERY; WATER; CRYSTALS; LIGHT; PHOTOISOMERIZATION; VESICLES; SOLVENTS
Tags NZ, rivok
Tags International impact, Reviewed
Changed by Changed by: Ing. Nicole Zrilić, učo 240776. Changed: 10/4/2018 15:29.
Abstract
We designed and studied the structure, dynamics, and photochemistry of photoswitchable reverse micelles (RMs) composed of azobenzene-containing ammonium amphiphile 1 and water in chloroform at room and subzero temperatures by NMR spectroscopy and molecular dynamics simulations. The NMR and diffusion coefficient analyses showed that micelles containing either the E or Z configuration of 1 are stable at room temperature. Depending on the water-to-surfactant molar ratio, the size of the RMs remains unchanged or is slightly reduced because of the partial loss of water from the micellar cores upon extensive E -> Z or Z -> E photoisomerization of the azobenzene group in 1. Upon freezing at 253 or 233 K, E-1 RMs partially precipitate from the solution but are redissolved upon warming whereas Z-1 RMs remain fully dissolved at all temperatures. Light-induced isomerization of 1 at low temperatures does not lead to the disintegration of RMs remaining in the solution; however, its scope is influenced by a precipitation process. To obtain a deeper molecular view of RMs, their structure was characterized by MD simulations. It is shown that RMs allow for amphiphile isomerization without causing any immediate significant structural changes in the micelles.
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GA15-12386S, research and development projectName: Dynamika a (foto)chemie polutantů na rozhraních led/vzduch a voda/vzduch z experimentu i teorie
Investor: Czech Science Foundation
LM2015051, research and development projectName: Centrum pro výzkum toxických látek v prostředí (Acronym: RECETOX RI)
Investor: Ministry of Education, Youth and Sports of the CR
LO1214, research and development projectName: Centrum pro výzkum toxických látek v prostředí (Acronym: RECETOX)
Investor: Ministry of Education, Youth and Sports of the CR
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