36 research outputs found
(5-Ethenyl-1-azabicyclo[2.2.2]octan-2-yl)(6-methoxy-3-quinolyl)methanol methanol solvate
In the title methanol solvate, C20H24N2O2·CH4O, an L-shaped conformation is found as the two substituents at the central hydroxy group are almost orthogonal to each other [the C—C—C angle at the central sp
3-C atom is 110.12 (13)°]. The most notable feature of the crystal packing is the formation of supramolecular chains along the b direction mediated by O—H⋯N hydrogen bonds occurring between the hydroxy and quinoline N atoms; the methanol molecules are linked to these chains via O—H⋯Namine hydrogen bonds. C—H⋯O interactions also occur
1-[3,5-Bis(trifluoromethyl)phenyl]-3-[(5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)(6-methoxyquinolin-4-yl)methyl]thiourea–l-proline–methanol (1/1/1)1
In the methanol solvate of the title 1:1 cocrystal, C29H28F6N4OS·C5H9NO2·CH4O, the l-proline molecule exists as a zwitterion. In the crystal, the disubstituted thiourea, l-proline and methanol molecules are linked by N—H⋯O and N—H⋯N hydrogen bonds, forming a two-dimensional array in the ab plane
1-Cyclohexyl-3-{(E)-[1-(pyridin-2-yl)ethylidene]amino}thiourea
In the title thiourea derivative, C14H20N4S, the non-ring non-H atoms are approximately planar, with an r.m.s. deviation of 0.0720 Å. The pyridine ring is twisted out of this plane and makes a dihedral angle of 16.85 (13)° with it. The mean plane passing through the cyclohexyl ring is almost normal to the central plane [dihedral angle = 69.23 (8)°]. An intramolecular N—H⋯N(imine) hydrogen bond occurs. Centrosymmetric dimers are formed in the crystal structure via pairs of N—H⋯S hydrogen bonds, and these are connected into a supramolecular chain along the a axis via C—H⋯π(pyridyl) interactions
ChemInform Abstract: A New Catalytic Mode of the Modularly Designed Organocatalysts (MDOs): Enantioselective Synthesis of Dihydropyrano[2,3-c]pyrazoles.
ChemInform Abstract: Michael Addition of Ketones and Aldehydes to Maleimides Catalyzed by Modularly Designed Organocatalysts.
Turbulence collapses at a threshold particle loading in a dilute particle-gas suspension
Direct Numerical Simulations (DNS) of the flow of a particle-gas suspension in a channel have been carried out to examine the turbulence attenuation due to particles. As the volume fraction is increased in the range , there is a discontinuous decrease in the turbulent velocity fluctuations at a critical volume fraction. The turbulent energy production rate decreases by an order of magnitude, accompanied by a much smaller increase in the energy dissipation due to particle drag, resulting in a decrease in the total energy dissipation. In contrast to the current understanding, the results show that turbulence attenuation is a discontinuous process, and is due to a disruption of the turbulent energy production mechanism, and not due to the increased dissipation due to the particles