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Hydrogen Bonding Properties of the Complexes of Formaldehyde and its Derivatives with HF and HCl

✍ Scribed by Maria Wiśniewska; Sławomir J. Grabowski


Book ID
106215030
Publisher
Springer Vienna
Year
2002
Tongue
English
Weight
77 KB
Volume
133
Category
Article
ISSN
0026-9247

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An ab initio SCF-MO study of the weakly
✍ Alan Hinchliffe 📂 Article 📅 1981 🏛 Elsevier Science ⚖ 280 KB

Large-scale gaussian orbital SCF-MO results are reported for the title molecules. R,(X... H) and De(X...H) values are given, and in either case the complexes OC...HF and DC...HCl are more stable than the corresponding CO...HX complexes. The changes on electronic distribution on complex formation are