Cocrystals for photochemical solid-state reactions: An account on crystal engineering perspective
Syntheses of functional cyclobutanes, ie, strained four-membered ring compounds are
mainly achieved via photochemical [2+ 2] cycloaddition reaction. The key is to bring two …
mainly achieved via photochemical [2+ 2] cycloaddition reaction. The key is to bring two …
Strong N−X⋅⋅⋅O−N Halogen Bonds: A Comprehensive Study on N‐Halosaccharin Pyridine N‐Oxide Complexes
R Puttreddy, JM Rautiainen, T Mäkelä… - Angewandte Chemie …, 2019 - Wiley Online Library
A study of the strong N− X⋅⋅⋅− O− N+ (X= I, Br) halogen bonding interactions reports 2× 27
donor× acceptor complexes of N‐halosaccharins and pyridine N‐oxides (PyNO). DFT …
donor× acceptor complexes of N‐halosaccharins and pyridine N‐oxides (PyNO). DFT …
Bridging the void: Halogen bonding and aromatic interactions to program luminescence and electronic properties of π-conjugated materials in the solid state
SA Sharber, WJ Mullin, SW Thomas III - Chemistry of Materials, 2021 - ACS Publications
π-Conjugated materials are promising candidates for emerging organic optoelectronic
devices empowered by molecular design. The unsolved challenges of predicting and …
devices empowered by molecular design. The unsolved challenges of predicting and …
Enhancing supramolecular assembly in bodipy derivatives: harnessing halogen bonding for cocrystal design
G Gümüşgöz Çelik, B Dedeoglu… - Crystal Growth & …, 2023 - ACS Publications
Supramolecular synthesis, a field of study in chemistry, offers a versatile approach to
construct complex structures using non-covalent interactions. In this study, we explore the …
construct complex structures using non-covalent interactions. In this study, we explore the …
Simple iodoalkyne-based organocatalysts for the activation of carbonyl compounds
JV Alegre-Requena, A Valero-Tena… - Organic & …, 2020 - pubs.rsc.org
A novel approach for the formation of bisindolylmethane derivatives (BIMs) is described as a
proof of concept to evaluate the catalytic capacity of iodoalkynes. The use of these …
proof of concept to evaluate the catalytic capacity of iodoalkynes. The use of these …
Hydrogen-and Halogen-Bonded Binary Cocrystals with Ditopic Components: Systematic Structural and Photoreactivity Properties That Provide Access to a Completed …
J Quentin, LR MacGillivray - Crystal Growth & Design, 2020 - ACS Publications
A series of binary cocrystals involving the ditopic hydrogen-and halogen-bond (H-and X-
bond, respectively) donors resorcinol (res) and hydroquinone (hq), and 1, 3-and 1, 4 …
bond, respectively) donors resorcinol (res) and hydroquinone (hq), and 1, 3-and 1, 4 …
Quantitative analysis of weak non-covalent interactions in (Z)-3-(4-halophenyl)-2-(pyridin-2/3/4-yl) acrylonitriles
P Venkatesan, M Cerón, S Thamotharan, F Robles… - …, 2018 - pubs.rsc.org
A detailed experimental and theoretical investigation on the intermolecular interactions in (Z)-
3-(4-halophenyl)-2-(pyridin-2/3/4-yl) acrylonitriles is reported. The intermolecular …
3-(4-halophenyl)-2-(pyridin-2/3/4-yl) acrylonitriles is reported. The intermolecular …
Halogen versus Hydrogen Bonding in Binary Cocrystals: Novel Conformation a Coformer with [2+ 2] Photoreactivity of Criss‐Crossed C= C Bonds
J Quentin, LR MacGillivray - ChemPhysChem, 2020 - Wiley Online Library
A series of cocrystals involving the hydrogen‐and halogen‐bond donor coformers catechol
(cat) and 1, 2‐diiodotetrafluorobenzene (1, 2‐di‐I‐tFb), respectively, is reported. Each …
(cat) and 1, 2‐diiodotetrafluorobenzene (1, 2‐di‐I‐tFb), respectively, is reported. Each …
The Halogen Bond to Ethers-Prototypic Molecules and Experimental Electron Density
A Schmidt, A Krupp, J Kleinheider… - ACS …, 2024 - ACS Publications
Halogen bonds to dialkyl ether molecules have remained largely unexplored. We here
address the synthesis and the structural chemistry of the first halogen-bonded noncyclic …
address the synthesis and the structural chemistry of the first halogen-bonded noncyclic …
Real-space approach to the reaction force: Understanding the origin of synchronicity/nonsynchronicity in multibond chemical reactions
D Yepes, J Munarriz, D l'Anson… - The Journal of …, 2020 - ACS Publications
In this article, we present a complementary analysis based on the reaction force F
(ξ)/reaction force constant κ (ξ) and noncovalent interactions (NCI) index to characterize the …
(ξ)/reaction force constant κ (ξ) and noncovalent interactions (NCI) index to characterize the …