نتایج جستجو برای: 8 8 stacking interactions
تعداد نتایج: 1032170 فیلتر نتایج به سال:
stability of the π-π stacking interactions in the ben||n-substituted-coronene complexes was studied using the computational quantum chemistry methods (where ben is benzene and || denotes π-π stacking interaction, and n-substituted-coronene is coronene molecule which substituted with different number of n atoms). the results reveal simultaneous effects of structure and number of heteroatom on th...
Stability of the π-π stacking interactions in the Ben||N-substituted-coronene complexes was studied using the computational quantum chemistry methods (where Ben is benzene and || denotes π-π stacking interaction, and N-substituted-coronene is coronene molecule which substituted with different number of N atoms). The results reveal simultaneous effects of structure and number of Heteroatom on th...
4-(4H-1,2,4-Triazol-4-yl)phenol (compound I) as a triazol aromatic compound was obtained by the reaction diformylhydrazineand p-aminophenol in dimethylformamide (DMF) under hydrothermal condition. The crystal structure of this compound was determined by FT-IR spectroscopy, NMR, elemental analysis and single crystal X-ray diffraction method. Crystallographic data for I was collected at 298 K. Th...
The mol-ecule of the title compound, C(8)H(6)N(4)S, is almost planar [maximum deviation from the mean plane = 0.020 (1) Å for the S atom]. In the crystal, a supra-molecular three-dimensional arrangement arises from N-H⋯N hydrogen bonds and weak aromatic stacking interactions along the a axis [centroid-centroid separation = 3.582 (2) Å].
There has been considerable recent interest in the ecosystem consequences of global and regional shifts in biogeochemical cycling and the loss of species diversity. Since biogeochemical cycling is the result of an interaction of numerous organisms, the link between diversity and biogeochemistry is a natural one. changes in either diversity or biogeochemiical &ling can dramatically influence one...
The title compound, C(17)H(14)ClN(7), crystallizes with two independent mol-ecules in the asymmetric unit. Inter-molecular N-H⋯N and C-H⋯N hydrogen bonds contribute to the stability of the crystal structure. In addition, weak C-H⋯π and π-π stacking [centroid-centroid distances of 3.699 (8) and 3.699 (6) Å] interactions are observed.
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