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Hydrogen bond acceptance/electron pair surfaces

Our focus in this chapter shall be primarily upon the surface electrostatic potential, specifically its most positive and most negative values, denoted by Vs, max and Vs,min, respectively. There may be several local and absolute maxima and minima on a given surface. They indicate the most positive and negative sites. The former are often associated with hydrogens, especially acidic ones, and the latter with lone pairs, tt electrons of unsaturated molecules and strained bonds. We have demonstrated that Vs niax and Vs nim correlate well with measures of hydrogen bond donating and accepting tendencies . [Pg.7]


See other pages where Hydrogen bond acceptance/electron pair surfaces is mentioned: [Pg.54]    [Pg.524]    [Pg.50]    [Pg.849]    [Pg.90]    [Pg.105]    [Pg.187]    [Pg.102]    [Pg.215]    [Pg.118]    [Pg.320]    [Pg.307]   
See also in sourсe #XX -- [ Pg.399 ]




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Bonded pairs

Bonding pair

Electron accepter

Electron pairs bonding

Electron-accepting

Electron-pair bonds

Hydrogen bond acceptance/electron pair

Hydrogen bond accepting

Hydrogen electrons

Hydrogen pairing

Hydrogen-bonded pair

Surface bonds

Surface electronic

Surface electrons

Surfaces hydrogen

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