Development of a QSPR model for predicting thermal stabilities of nitroaromatic compounds taking into account their decomposition mechanisms [PDF]
, 2010 International audienceThe molecular structures of 77 nitroaromatic compounds have been correlated to their thermal stabilities by combining the quantitative structure-property relationship (QSPR) method with density functional theory (DFT). More than 300
Adamo, Carlo +3 more
core +3 more sources
2,4,6-Tris(isopropylamino)-1,3,5-trinitrobenzene : Probing the Impact of Crystal Packing Forces in the Dimorphs and the Cocrystals–Experimental and Theoretical Study [PDF]
, 2004 We attempted to obtain a large amount of solvates of 2,4,6-tris(isopropylamino)-1,3,5-trinitrobezene 1 and tried to embark on a systematic study (both experimentally and theoretically) of conformational effects of crystal packing.
El-Derby, Soheir
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Two-component organic crystals without hydrogen bonding: structure and intermolecular interactions in bimolecular stacking [PDF]
, 2017 A survey of crystal structures including two organic compounds unable to form hydrogen bonding has been carried out using the Cambridge Structural Database. Such systems are common and numerous.
A. Gavezzotti, L. Lo Presti, V. Colombo
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Protective copolymers for nonviral gene vectors: synthesis, vector characterization and application in gene delivery [PDF]
, 2000 Uncontrolled interactions of gene vectors and drug carriers in and with an in vivo environment pose serious limitations to their applicability. In order to reduce such interactions we have designed, synthesized and applied novel copolymers of poly ...
Erbacher, P. (P) +4 more
core +1 more source
1,3,5-Tris(dialkylamino)benzenes : model compounds for the electrophilic substitution and oxidation of aromatic compounds [PDF]
, 2009 Anionic σ complexes have been known and extensively studied as intermediates of nucleophilic aromatic substitution since the beginning of the century.
Effenberger, Franz
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Improved Transparency-Nonlinearity Trade-Off with Boroxine-Based Octupolar Molecules
, 2004 C. Katan present address: CNRS UMR6082 FOTON, INSA de Rennes, 20 avenue des Buttes de Coësmes, CS 70839, 35708 RENNES cedex 7, FranceInternational audienceOver the last two decades, a substantial effort has been devoted to the design of molecules with ...
Alcaraz, Gilles +5 more
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Structure - reactivity patterns in nucleophilic addition to activated aromatic compounds [PDF]
, 1990 Kinetic and equilibrium data for the reactions of some aromatic nitro compounds with nucleophiles have been investigated using various spectrophotometric techniques (UV/visible, stopped-flow and temperature jump) and nmr spectroscopy.
Stevens, James Andrew
core
Some studies of the interactions of aromatic nitro-compounds with nucleophiles [PDF]
, 1975 The interactions of some aromatic nitro-compounds with nucleophiles in protic solvents and in protic-dipolar aprotic solvent mixtures have been investigated using the techniques of proton magnetic resonance and visible spectroscopy and stopped-flow ...
Willison, Michael J.
core
Current Cell/Organoid and Animal Models for Primary Sclerosing Cholangitis
Portal Hypertension &Cirrhosis, EarlyView.Primary sclerosing cholangitis (PSC) is a chronic cholestatic liver disease with limited therapeutic options and a marked risk of progression to biliary fibrosis, cirrhosis, and malignancy. Progress in PSC research has been hindered by the lack of models that faithfully recapitulate the complex biliary microenvironment and disease heterogeneity ...
Qigu Yao +4 more
wiley +1 more source
Ultrasound Characterization of Plastic Bonded Explosives With Varied Binder Content and Density
Propellants, Explosives, Pyrotechnics, EarlyView.ABSTRACT Advanced explosive formulations and methods of production require rapid characterization for both processes and materials. Here, we present results for ultrasound characterization of a plastic bonded explosive (PBX) formulation as a function of binder weight percent and pressing density using through‐transmission sound speed measurements.
Jordan S. Lum +6 more
wiley +1 more source