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Hydrogen bonding experimental evidence

Interactions Compete against Hydrogen Bonds Experimental Evidence and Rationalization Based on ab Initio Calculations. Journal of the American Chemical Society, 124(23), 6781-6786. [Pg.166]

Table 6 reports theoretical and experimental data relative to the red shift for the intramolecular stretching frequency of the HCl bond in the complex. This is greater than that observed for the H2O-HCI system, a further evidence of the strength of this hydrogen bond. Experimental data, however, show large differences between the Aco recorded in different matrixes. The first IR investigation was accomplished by Ault and Pimentel [30] in N2 matrix but later, in a more complete study, Barnes et al. [35]... [Pg.365]

The implications of these deductions seem to lead to the conclusion that such structural factors as chain length, methyl groups, and double bonds influence not only the physical properties but the chemical properties of the hydrocarbon as well. Hydrocarbons are limited in their chemical reactivity. The paraffins are compounds having small affinity. The hydrocarbon molecules are armor-plated with hydrogen. Since structure plays so vital a role in the rate of combustion, there must be a fundamental difference in the relative reactivity of the hydrogen atoms. Experimental evidence that such is the case is accumulating. There are reasons to believe that methods are at hand by which the... [Pg.371]

Products of SC hydrogenation. Another experimental evidence for the fact that SC is stabilized on the activated silica surface was obtained for the hydrogenation of the surface with molecular hydrogen (deuterium). The formation of silyl-hydride bonds during this process were first found by IR spectroscopy in Ref. [15], however, their structure has been identified later [54]. [Pg.286]

The lUPAC recommendations emphasize that experimental evidence is necessary to support the existence of a hydrogen bond. " Such evidence may be provided in a variety of ways ... [Pg.197]

Intermolecular alkene insertion into the Pd-N bond was shown to be a syn-addition process as well (Scheme 12) [42,47]. Amido complexes of palladium were found to coordinate alkene, undergo migratory insertion and finally to form enamine product after (3-hydrogen elimination. Experimental evidence for the ethylene amido intermediate and for yw-addition process was obtained by NMR spectroscopy, including deuterium labeling study. The rate constant of the decay of observed intermediate complexes leading to the formation of the enamine corresponded to AG of 17 kcal/mol (8.7 x 10 " s -40 "C) [42]. [Pg.15]

As pointed out in the introduction, if one of the substituents on the nitrogen atom is a hydrogen atom, tautomeric equilibrium between enamino and imino forms strongly favors the latter form 18,140,141). According to physiochemical measurements, the occurrence of simply substituted /1 -pyrrolines and zl -piperideines is very improbable. The formulation of this type of compound with a double bond in the position (used mainly by early authors) was of formal meaning only, having no experimental evidence (142-144). [Pg.265]

Both of these structures satisfy the formal valence rules for carbon, but each has a serious fault. Each structure shows three of the carbon-carbon bonds as double bonds, and three are shown as single bonds. There is a wealth of experimental evidence to indicate that this is not true. Any one of the six carbon-carbon bonds in benzene is. the same as any other. Apparently the fourth bond of each carbon atom is shared equally with each adjacent carbon. This makes it difficult to represent the bonding in benzene by our usual line drawings. Benzene seems to be best represented as the superposition or average of the two structures. For simplicity, chemists use either one of the structures shown in (30) usually expressed in a shorthand form (SI) omitting the hydrogen atoms ... [Pg.343]

Dalai NS, Gunaydin-Sen O, Bussmann-Holder A (2007) Experimental Evidence for the Coexistence of Order/Disorder and Displacive Behavior of Hydrogen-Bonded Ferroelectrics and Antiferroelectrics. 124 23-50 Dalai NS, see Bussmann-Holder A (2007) 124 1-21 Daul CA, see Atanasov M (2003) 106 97-125... [Pg.220]

A variety of hypothetical models have been proposed for the alamethicin pores. These generally invoke the bent helix monomer conformation, hydrogen bonding between adjacent helical monomers, and structural features compatible with the voltage dependence of the channels 201-204). Unfortunately experimental evidence is insufficient to distinguish between these models at present. [Pg.184]

It would appear that increasing the amount of stannous chloride catalyst, under our experimental conditions, as well as increasing the amount of oil formed decreases the amount of polar compounds in the oil which decreases the hydrogen bonding and therefore helps to decrease the viscosity of the oil. Spectroscopic evidence indicates that there is little change in the hydrocarbon structures present. [Pg.277]

Clays consist of parallel silicate layers in kaolinite, two unsymmetrical types of layers are linked by hydrogen bonds. One consists of aluminium ions and hydroxyl groups, the other of silicon and oxygen ions. Cairns-Smith does not postulate a detailed mechanism, but only describes the main thrust of his argument. Critics complain that clear experimental results are not available (however, other proponents of new hypotheses often provide no evidence to back up their suggestions ). [Pg.182]

In Chapter 8, Stavola and Pearton discuss the local vibrational modes of complexes in Si that contain hydrogen or deuterium. They also show how one can use applied stress and polarized light to determine the symmetry of the defects. In the case of the B-H complex, the bond-center location of H is confirmed by vibrational and other measurements, although there are some remaining questions on the stress dependence of the Raman spectrum. The motion of H in different acceptor-H complexes is discussed for the Be-H complex, the H can tunnel between bond-center sites, while for B-H the H must overcome a 0.2 eV barrier to move between equivalent sites about the B. In the case of the H-donor complexes, instead of bonding directly to the donor, H is in the antibonding site beyond the Si atom nearest to the donor. The main experimental evidence for this is that nearly the same vibrational frequency is obtained for the different donor atoms. There is also a discussion of the vibrational modes of H tied to crystal defects such as those introduced by implantation. The relationship of the experimental results to recent theoretical studies is discussed throughout. [Pg.22]


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See also in sourсe #XX -- [ Pg.4 , Pg.7 , Pg.20 ]




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