Unravelling the Cocrystallization-Charge Transport Relation in Conjugated Polymer Blends via Meniscus-Assisted Solution-Shearing.
Sign Up to like & getrecommendations! Published in 2022 at "Macromolecular rapid communications"
DOI: 10.1002/marc.202200622
Abstract: The ability to craft the cocrystallization in conjugated polymer blends represents an important endeavor for the enhancement of charge transport. However, simple and efficient approaches to cocrystallization have yet to be realized. Herein, we report,… read more here.
Keywords: polymer blends; conjugated polymer; cocrystallization; charge transport ... See more keywords
In silico screening of dicarboxylic acids for cocrystallization with phenylpiperazine derivatives based on both cocrystallization propensity and solubility advantage
Sign Up to like & getrecommendations! Published in 2017 at "Journal of Molecular Modeling"
DOI: 10.1007/s00894-017-3287-y
Abstract: In silico screening was performed to search for binary solids in which a phenylpiperazine-derivative drug was cocrystallized with a dicarboxylic acid. The phenylpiperazine derivative could be any of 61 such drugs, while the dicarboxylic acid… read more here.
Keywords: solubility advantage; cocrystallization; silico screening; solubility ... See more keywords
Cocrystallization of Chiral 3d-4f Clusters {Mn10Ln6} and {Mn6Ln2}.
Sign Up to like & getrecommendations! Published in 2021 at "Inorganic chemistry"
DOI: 10.1021/acs.inorgchem.1c00333
Abstract: Cocrystallization of different metal nanoclusters facilitates the preparation of cluster-based nanomaterials with enhanced properties. Herein, two pairs of enantiomeric 3d-4f cocrystallization structures of clusters R/S-[Mn10Ln6] and R/S-[Mn6Ln2] (Ln = Dy for 1R and 1S, Y… read more here.
Keywords: clusters mn10ln6; chemistry; mn10ln6 mn6ln2; cocrystallization ... See more keywords
Solubility Determination of Nicotinamide and Its Application for the Cocrystallization with Benzoic Acid
Sign Up to like & getrecommendations! Published in 2018 at "Journal of Chemical & Engineering Data"
DOI: 10.1021/acs.jced.8b00560
Abstract: Solubility of nicotinamide in a series of pure solvents, including ethanol, 1-propanol, isopropanol, ethyl acetate, methanol, 1-butanol, methyl acetate, isobutanol, acetone, and butyl acetate, was measured between 283.15 and 323.15 K. The solubility data increase… read more here.
Keywords: acetate; cocrystallization; benzoic acid; solubility ... See more keywords
Study on the Cocrystallization Mechanism of CL-20/HMX in a Propellant Aging Process through Theoretical Calculations and Experiments
Sign Up to like & getrecommendations! Published in 2022 at "ACS Omega"
DOI: 10.1021/acsomega.1c07328
Abstract: Energetic materials undergo physical and chemical aging due to environmental effects, resulting in the degradation of safety and detonation performances. Therefore, studying the aging performance of energetic materials is of great importance for the efficient… read more here.
Keywords: hmx; cocrystallization; mechanism; based propellant ... See more keywords
The borderline: exploring the structural landscape of triptycene in cocrystallization with ferrocene
Sign Up to like & getrecommendations! Published in 2020 at "CrystEngComm"
DOI: 10.1039/c9ce01734h
Abstract: Cocrystallization of the geometrically demanding triptycene (TripH) with the compact and electron-rich ferrocene (FcH) and its derivatives afforded C–H---πCp assembled supramolecular chains of alternating (C5H5)(C5H4R)Fe and TripH molecules in a series of binary crystals: FcH/TripH… read more here.
Keywords: ferrocene; structural landscape; cocrystallization; borderline ... See more keywords
Structure and absolute configuration of liquid molecules based on adamantane derivative cocrystallization
Sign Up to like & getrecommendations! Published in 2022 at "RSC Advances"
DOI: 10.1039/d1ra09284g
Abstract: Liquid molecules are difficult to crystallize, and their structures and absolute configurations cannot be directly determined by X-ray crystallography. We herein report the rapid cocrystallization of tetraaryladamantanes with liquid molecules. The structure of the liquid… read more here.
Keywords: absolute configuration; structure; liquid molecules; cocrystallization ... See more keywords
Thermal-induced transformation of glutamic acid to pyroglutamic acid and self-cocrystallization: a charge-density analysis.
Sign Up to like & getrecommendations! Published in 2022 at "Acta crystallographica. Section C, Structural chemistry"
DOI: 10.1107/s2053229621013607
Abstract: Thermal-induced transformation of glutamic acid to pyroglutamic acid is well known. However, confusion remains over the exact temperature at which this happens. Moreover, no diffraction data are available to support the transition. In this article,… read more here.
Keywords: glutamic acid; acid; analysis; acid pyroglutamic ... See more keywords
From Liquid to Solid: Cocrystallization as an Engineering Tool for the Solidification of Pyruvic Acid
Sign Up to like & getrecommendations! Published in 2023 at "Crystals"
DOI: 10.3390/cryst13050808
Abstract: Pyruvic acid is an organic compound used in various fields (e.g., the pharmaceutical, cosmetic, food, and chemical industries) and subject to constantly growing demand. Pyruvic acid is liquid at room temperature, rendering manipulation less straightforward.… read more here.
Keywords: tool; pyruvic acid; acid; cocrystallization ... See more keywords
Effects of Cocrystallization on the Structure and Properties of Melt-Cast Explosive 2,4-Dinitroanisole: A Computational Study
Sign Up to like & getrecommendations! Published in 2022 at "Molecules"
DOI: 10.3390/molecules27249010
Abstract: Melt-cast explosive 2,4-dinitroanisole (DNAN) crystal and its cocrystals DNAN/1,3-dinitrobenzene (DNB) and DNAN/2-nitroaniline (NA) were used to identify the effects of cocrystallization on the crystal structure, non-covalent interactions, and melting points of the DNAN crystal through… read more here.
Keywords: structure; explosive dinitroanisole; effects cocrystallization; cast explosive ... See more keywords
Virtual Screening, Structural Analysis, and Formation Thermodynamics of Carbamazepine Cocrystals
Sign Up to like & getrecommendations! Published in 2023 at "Pharmaceutics"
DOI: 10.3390/pharmaceutics15030836
Abstract: In this study, the existing set of carbamazepine (CBZ) cocrystals was extended through the successful combination of the drug with the positional isomers of acetamidobenzoic acid. The structural and energetic features of the CBZ cocrystals… read more here.
Keywords: virtual screening; cbz cocrystals; thermodynamics; analysis ... See more keywords