Model calculations of chemical interactions. Part 3.—Rotational energy profiles in simple molecules: evaluation, additivity and role of bond–bond, bond–lone-pair and lone-pair–lone-pair interactions

Augusto Rastelli; Marina Cocchi

doi:10.1039/ft9918700249

Model calculations of chemical interactions. Part 3.—Rotational energy profiles in simple molecules: evaluation, additivity and role of bond–bond, bond–lone-pair and lone-pair–lone-pair interactions

Journal of the Chemical Society Faraday Transactions ◽

10.1039/ft9918700249 ◽

1991 ◽

Vol 87 (2) ◽

pp. 249-258 ◽

Cited By ~ 18

Author(s):

Augusto Rastelli ◽

Marina Cocchi

Keyword(s):

Lone Pair ◽

Rotational Energy ◽

Chemical Interactions ◽

Model Calculations ◽

Energy Profiles ◽

Simple Molecules ◽

Lone Pair Interactions ◽

Pair Interactions

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The Role of Lone Pair Interactions in the Chemistry of the Monosacceharides. The Aromatic Effects

Heterocycles ◽

10.3987/rev-90-414 ◽

1990 ◽

Vol 31 (6) ◽

pp. 1157 ◽

Cited By ~ 52

Author(s):

Vernon G. S. Box ◽

Veron G. S. Box

Keyword(s):

Lone Pair ◽

Lone Pair Interactions ◽

Pair Interactions

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The Role of Lone Pair Interactions in the Chemistry of Monosaccharides. The Selective Esterification of 4,6-O-Benzylidene-Hexopyranosides

Heterocycles ◽

10.3987/r-1983-08-1641 ◽

1983 ◽

Vol 20 (8) ◽

pp. 1641 ◽

Cited By ~ 5

Author(s):

Vernon G. S. Box

Keyword(s):

Lone Pair ◽

Selective Esterification ◽

Lone Pair Interactions ◽

Pair Interactions

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The Role of Lone Pair Interactions in the Selective Functionalisation of Some 4,6-O-Benzylidene-hexopyranosides by Both the Phase Transfer Esterification Reactions and the Tin-mediated Esterification and Alkylation Reactions

Heterocycles ◽

10.3987/r-1983-04-0677 ◽

1983 ◽

Vol 20 (4) ◽

pp. 677 ◽

Cited By ~ 8

Author(s):

Vernon G. S. Box

Keyword(s):

Phase Transfer ◽

Lone Pair ◽

Esterification Reactions ◽

Alkylation Reactions ◽

Lone Pair Interactions ◽

Pair Interactions

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The Role of Lone Pair Interactions in the Chemistryof the Anomeric Centre of Monosaccharides

Heterocycles ◽

10.3987/r-1984-04-0891 ◽

1984 ◽

Vol 22 (4) ◽

pp. 891 ◽

Cited By ~ 10

Author(s):

Vernon G. S. Box

Keyword(s):

Lone Pair ◽

Lone Pair Interactions ◽

Pair Interactions

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Role of lone-pair interactions and local disorder in determining the interdependency of optical constants ofa−CN:Hthin films

Physical Review B ◽

10.1103/physrevb.66.195415 ◽

2002 ◽

Vol 66 (19) ◽

Cited By ~ 31

Author(s):

G. Fanchini ◽

A. Tagliaferro ◽

N. M. J. Conway ◽

C. Godet

Keyword(s):

Optical Constants ◽

Lone Pair ◽

Local Disorder ◽

Lone Pair Interactions ◽

Pair Interactions

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The role of lone pair interactions in the chemistry of the monosaccharides. The mechanisms of the oxidations of monosaccharides by bromine, chromium trioxide in acetic acid, and ozone

Journal of Molecular Structure ◽

10.1016/s0022-2860(01)00466-5 ◽

2001 ◽

Vol 569 (1-3) ◽

pp. 167-178 ◽

Cited By ~ 9

Author(s):

V.G.S. Box

Keyword(s):

Acetic Acid ◽

Chromium Trioxide ◽

Lone Pair ◽

Lone Pair Interactions ◽

Pair Interactions

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Theory regarding the role of lone-pair interactions in through-space fluorine-fluorine nuclear spin-spin coupling

Journal of the American Chemical Society ◽

10.1021/ja00804a034 ◽

1973 ◽

Vol 95 (23) ◽

pp. 7747-7752 ◽

Cited By ~ 65

Author(s):

Frank B. Mallory

Keyword(s):

Nuclear Spin ◽

Lone Pair ◽

Spin Coupling ◽

Spin Spin Coupling ◽

Lone Pair Interactions ◽

Pair Interactions

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ChemInform Abstract: The Role of Lone-Pair Interactions in the Chemistry of the Monosaccharides. Stereoelectronic Effects in Unsaturated Monosaccharides.

ChemInform ◽

10.1002/chin.199146337 ◽

2010 ◽

Vol 22 (46) ◽

pp. no-no

Author(s):

V. G. S. BOX

Keyword(s):

Lone Pair ◽

Stereoelectronic Effects ◽

Lone Pair Interactions ◽

Pair Interactions

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ChemInform Abstract: THE ROLE OF LONE PAIR INTERACTIONS IN THE CHEMISTRY OF MONOSACCHARIDES. THE SELECTIVE ESTERIFICATION OF 4,6-O-BENZYLIDENEHEXOPYRANOSIDES

Chemischer Informationsdienst ◽

10.1002/chin.198403364 ◽

1984 ◽

Vol 15 (3) ◽

Author(s):

V. G. S. BOX

Keyword(s):

Lone Pair ◽

Selective Esterification ◽

Lone Pair Interactions ◽

Pair Interactions

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ChemInform Abstract: A THEORY REGARDING THE ROLE OF LONE-PAIR INTERACTIONS IN ′THROUGH-SPACE′ FLUORINE-FLUORINE NUCLEAR SPIN-SPIN COUPLING

Chemischer Informationsdienst ◽

10.1002/chin.197404066 ◽

1974 ◽

Vol 5 (4) ◽

pp. no-no

Author(s):

FRANK B. MALLORY

Keyword(s):

Nuclear Spin ◽

Lone Pair ◽

Spin Coupling ◽

Spin Spin Coupling ◽

Lone Pair Interactions ◽

Pair Interactions

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