The trans-»eis photoisomerization of a series of substituted stilbazolium salts (A t X , At: trans-l-alkyl-4-[4-R-styryl]-pyridinium and -quinolinium, R = CN. H, CH3 and OCH3, X " = T and CIO4) was studied by laser flash photolysis and steady state irradiation measurements. The quantum yields of eis ^ trans photoisomerization (<£c_t and $ t _ c ) and of fluorescence of the trans isomers (f) ...

A dithienyl unit in a N,C-chelate monoboryl compound has been found to completely stabilize a N,C-chelate boryl chromophore toward photoisomerization. N,C-chelate diboryl compounds that contain a dithienyl unit display a similar high stability toward photoisomerization. This greatly enhanced photostability is attributed to the π → π* transition and luminescence involving the dithienyl uni...

Here we report a cavitand with a photochemical switch as one of the container walls. The azo-arene switch undergoes photoisomerization when subjected to UV light producing a self-fulfilled cavitand. This process is thermally and photochemically reversible. The reported cavitand binds small molecules and these guests can be ejected from the cavitand through this photochemical process.

In this article, we use the popular photoswitchable molecule, azobenzene, to demonstrate that the embedding in a nanoporous, crystalline solid enables a precise understanding of light-induced, reversible molecular motion. We investigate two similar azobenzene-containing, pillared-layer metal-organic frameworks (MOFs): Cu2(AzoBPDC)2(BiPy) and Cu2(NDC)2(AzoBiPy). Experimental results from UV-vis ...

We have employed the SA2-CAS(4,4)/6-31G ab initio method together with an on-the-fly global-switching trajectory surface hopping algorithm to simulate photoisomerization reaction dynamics from reactant trans, trans-1,4-diphenyl-1,3-butadiene (DPB) to products cis,trans-DPB and cis,cis-DPB. This topic has been extensively studied experimentally and the present theoretical study is the first to s...

Journal of the American Chemical Society is published by the American Chemical Society. 1155 Sixteenth Street N.W., Washington, DC 20036 Communication Arginine52 Controls the Photoisomerization Process in Photoactive Yellow Protein Gerrit Groenhof, Lars V. Schfer, Martial Boggio-Pasqua, Helmut Grubmller, and Michael A. Robb J. Am. Chem. Soc., 2008, 130 (11), 3250-3251• DOI: 10.1021/ja078024u • ...

We have studied the photochromic reaction of p-hydroxycinnamic-thiophenyl ester in the microcrystalline state. We attributed the fluorescence spectral evolution of the microcrystal, under UV irradiation, to the photoinduced trans-to-cis isomerization. The photocyclic behavior of the chromophore was demonstrated by cis-to-trans back reaction under a subsequent visible light irradiation. In addit...

For the solid-state photoisomerization of benzyl (Z,Z)-muconate to the corresponding (E,E)-muconate, the direct observation of a change in the crystal structure has revealed that the isomerization occurs by a topochemical reaction process according to a bicycle-pedal model and is finally accompanied by a phase transition to a stable crystal structure.

Ruthenium nitrosyl complexes are fascinating versatile photoactive molecules that can either undergo NO linkage photoisomerization or NO photorelease. The photochromic response of three ruthenium mononitrosyl complexes, trans-[RuCl(NO)(py)₄]2+, trans-[RuBr(NO)(py)₄]2+, and trans-(Cl,Cl)[RuCl₂(NO)(tpy)]⁺, has been investigated using density functional theory and time-dependent density functional...

A new method, non-Markovian quantum-classical approximation (NQCA), is suggested to model the photoisomerization of polyatomic molecules. The NQCA method can be successfully applied to follow the photoisomerization process for a wide class of reacting systems, namely, those for which the time scale required for the equilibration in the phase space of the potential energy surface (PESs) is short...