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E-grāmata: Halogen Bonding: Fundamentals and Applications

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  • Formāts: PDF+DRM
  • Sērija : Structure and Bonding 126
  • Izdošanas datums: 12-Apr-2008
  • Izdevniecība: Springer-Verlag Berlin and Heidelberg GmbH & Co. K
  • Valoda: eng
  • ISBN-13: 9783540743309
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Halogen Bonding: Fundamentals and ApplicationsPalielināt
  • Formāts: PDF+DRM
  • Sērija : Structure and Bonding 126
  • Izdošanas datums: 12-Apr-2008
  • Izdevniecība: Springer-Verlag Berlin and Heidelberg GmbH & Co. K
  • Valoda: eng
  • ISBN-13: 9783540743309
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This series presents critical reviews of the present position and future trends in modern chemical research concerned with chemical structure and bonding. It contains short and concise reports, each written by the world's renowned experts. The series is still valid and useful after five or ten years. More information is available at springerlink.com along with the electronic version of the whole content.

Recenzijas

From the reviews:









"The articles in this volume specifically address halogen bonding, and two aspects of it . The contributions to this volume are reasonably up-to-date . each chapter begins with a detailed table of contents and most of them also provide a list defining abbreviations. In summary, this is a very useful book that contains a great deal of information. I can certainly recommend it." (Peter Politzer, Journal of the American Chemical Society, Vol. 130 (31), 2008)

Theoretical Characterization of the Trends in Halogen Bonding
A. Karpfen
1
1 Introduction
2
2 XY···B Complexes
3
2.1 XY···NH3 Complexes
4
2.2 Other XY···Amine Complexes
10
3 C-X···B Complexes
11
3.1 C-X···N Complexes
12
3.2 C-X···H-C Complexes
12
4 Summary
13
References
14
The Interaction of Dihalogens and Hydrogen Halides with Lewis Bases in the Gas Phase: An Experimental Comparison of the Halogen Bond and the Hydrogen Bond
A.C. Legon
17
1 Introduction
18
1.1 Historical Background
18
1.2 Definitions and Nomenclature
19
1.3 Summary
21
2 Properties of Isolated Complexes B···XY: How to Measure Them
21
3 Comparison of the Angular and Radial Geometries of Halogen-Bonded Complexes B···XY and their Hydrogen-Bonded Analogues B···HX
23
3.1 Angular Geometries of B···ClF and B···HCl in Which B is a n-Pair Donor
25
3.1.1 B Carries a Single n-Pair
25
3.1.2 B Carries Two Equivalent n-Pairs
26
3.1.3 B Carries Two Inequivalent n-Pairs
35
3.2 Angular Geometries of B···ClF and B···HCl in Which B is a π-Pair Donor
36
3.2.1 B Carries a Single-π-Pair
36
3.2.2 B Carries Pseudo-π-Pairs
38
3.2.3 B Carries Several-π-Pairs
39
3.3 Angular Geometries of B···ClF and B···HCl in Which B is a Mixed n-Pair/π-Pair Donor
43
3.4 Radial Geometries of Complexes B···XY and B···HX: A Summary
47
4 Intermolecular Binding Strength in Halogen-Bonded Complexes: Systematic Behaviour of kσ
47
5 Extent of Electron Transfer in Halogen-Bonded Complexes B···XY
50
5.1 Electron Transfer in Weak (Outer) Complexes B···XY
50
5.2 Do Mulliken Inner Halogen-Bonded Complexes Exist in the Gas Phase?
54
6 Conclusions: A Model for the Halogen Bond in B···XY
56
References
59
Halogen Bonding with Dihalogens and Interhalogens
W.T. Pennington, T.W. Hanks, H.D. Arman
65
1 Introduction
66
1.1 Historical Background
66
1.2 Significance of Halogen Bonding with Dihalogens
68
2 Crystal Structures
69
2.1 General Observations
69
2.2 Nitrogen and Oxygen Electron Donors
87
2.3 Phosphorus and Sulfur Electron Donors
88
2.4 Arsenic and Selenium Electron Donors
89
3 Computation Studies
90
3.1 General Observations
90
3.2 Oxygen Electron Donors
92
3.3 Nitrogen Electron Donors
93
3.4 Sulfur and Selenium Electron Donors
95
3.5 π-Electron Donors
97
References
98
Halogen Bonding in Crystal Engineering
P. Metrangolo, G. Resnati, T. Pilati, S. Biella
105
1 Introduction
106
2 General Features of XB
107
2.1 Relative Effectiveness of XB vs. HB
109
2.2 XB and Electron Density Around Halogen Atoms
110
2.3 Structure and Role of the Halocarbon
114
2.4 Structure and Role of the Halocarbon Partner
115
2.5 Directionality of XB
116
3 Halogen-Bonded Supramolecular Architectures
118
3.1 1D Architectures
119
3.2 2D Architectures
122
3.3 3D Architectures
125
4 Conclusions
129
References
130
X-ray Structures and Electronic Spectra of the n-Halogen Complexes between Halogen Donors and Acceptors with n-Receptors
S.V. Rosokha, J.K. Kochi
137
1 Introduction
138
2 Electronic Spectroscopy and Thermodynamics of Donor/Acceptor Interactions with Halogen Derivatives
139
2.1 Dihalogen Complexes with Arenes and Alkenes
139
2.2 Complexes with Halocarbon Acceptors
141
2.3 Complexes of Halide Anions with Aromatic and Olefinic π-Acceptors
142
2.4 Unified Mulliken Correlations of Donor/Acceptor Complexes with Halogen Derivatives
144
3 Structural Features of Donor/Acceptor Complexes with Halogen Derivatives
146
3.1 Complexes of Dihalogen Acceptors with Aromatic and Olefinic π-Donors
146
3.2 Complexes of Polyhalogenated Methanes withπ-Donors
148
3.3 Complexes of Halide Anions with Aromatic and Olefinic π-Receptors
150
3.4 Donor/Acceptor (Structural) Effects on π-Halogen Interactions
155
3.4.1 Intermolecular Separations Relevant to Halogen Bonding
155
3.4.2 Molecular Geometries of Donor/Acceptor Moieties
155
4 Summary and Conclusions
156
References
157
Halogen-bonded Liquid Crystals
D.W. Bruce
161
1 Preamble
161
2 An Introduction to Thermotropic Liquid Crystals
162
2.1 Low Molar Mass Liquid Crystals
162
2.2 High Molar Mass Liquid Crystals
165
3 Characterisation of Liquid Crystal Mesophases
166
4 Liquid Crystals Formed Through Non-covalent Interactions
167
4.1 Quadrupolar Interactions
167
4.2 Charge-transfer Interactions
168
5 Hydrogen Bonding
169
6 Halogen-bonded Liquid Crystals
174
7 Future Prospects
179
References
179
Halogen Bonding in Conducting or Magnetic Molecular Materials
M. Fourmigue
181
1 Introduction
182
2 Neutral Radical Nitroxides
183
2.1 Halogenated Neutral Nitroxides
183
2.2 Binary Systems Involving Nitroxides
185
3 Conducting Materials Based on Tetrathiafulvalenes
186
3.1 An Introduction to Conducting TTF Salts
187
3.2 Neutral Halogenated TTFs
188
3.3 Cation Radical Salts of Halogenated TTFs
192
3.3.1 Hal···Halanion Interactions
192
3.3.2 Hal···Nitrile Interactions
197
3.3.3 Iodopyrazino TTFs, Iododithiapyrenes
200
3.4 Ternary Systems
202
4 Summary and Outlook
202
References 204
Author Index Volumes 101-126 209
Subject Index 219


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