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Topological analysis of hydrogen bonding interactions involving CH…O bonds

✍ Scribed by G.L. Sosa; N. Peruchena; R.H. Contreras; E.A. Castro


Book ID
114142274
Publisher
Elsevier Science
Year
1997
Tongue
English
Weight
782 KB
Volume
401
Category
Article
ISSN
0166-1280

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On the electrostatic directionality of N
✍ J.B.O. Mitchell; S.L. Price 📂 Article 📅 1989 🏛 Elsevier Science 🌐 English ⚖ 470 KB

The accessible minima in the electrostatic interaction energy of 29 bimolecular complexes containing N-H...O=C hydrogen bonds have been calculated, using ab initio distributed multipoles. The hydrogen bond geometries corresponding to these minima show the same statistical trends as found in crystal