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Dynamic and electrooptical properties of FH…F and FH…N hydrogen bridges

✍ Scribed by G. V. Yukhnevich; T. T. Merzlyak; O. Yu. Tsoi

Book ID
105596329
Publisher
Springer
Year
1997
Tongue
English
Weight
263 KB
Volume
46
Category
Article
ISSN
1573-9171

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## Abstract __Ab initio__ EOM‐CCSD calculations were performed to determine ^19^F,^1^H, ^19^F,^15^N and ^1^H,^15^N spin–spin coupling constants in model complexes FH–NH~3~ and FH–pyridine as a function of the F—H and F—N distances. The absolute value of ^1^__J__(F,H) decreases and that of ^1h^__J__