Introduction to modern vibrational spectroscopy:
Gespeichert in:
| 1. Verfasser: | |
|---|---|
| Format: | Buch |
| Sprache: | English |
| Veröffentlicht: |
New York u.a.
Wiley
1993
|
| Schriftenreihe: | A Wiley interscience publication
|
| Schlagworte: | |
| Online-Zugang: | Inhaltsverzeichnis |
| Beschreibung: | XIII, 285 S. graph. Darst. |
| ISBN: | 0471595845 |
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INTRODUCTION TO MODERN VIBRATIONAL SPECTROSCOPY MAX DIEM DEPARTMENT OF
CHEMISTRY CITY UNIVERSITY OF NEW YORK HUNTER COLLEGE A
WILEY-INTERSCIENCE PUBLICATION JOHN WILEY & SONS NEW YORK * CHICHESTER *
BRISBANE * TORONTO * SINGAPORE CONTENTS PREFACE 1 INTRODUCTION
REFERENCES, 4 2 RESULTS FROM QUANTUM MECHANICS 2.1 THE CONCEPTS OF
QUANTUM MECHANICS, 5 2.2 THE TIME-INDEPENDENT SCHROEDINGER EQUATION, 8
2.3 TIME-DEPENDENT DESCRIPTION, 12 2.4 TRANSITION MOMENTS FOR
ABSORPTION, 15 2.5 PARTICLE-IN-A-BOX: AN EXAMPLE FOR STATIONARY STATE
WAVEFUNCTIONS AND TRANSITION MOMENT, 17 2.6 THE VIBRATIONAL SCHROEDINGER
EQUATION, 21 2.7 THE VIBRATIONAL TRANSITION MOMENT, 26 2.8
ELECTROMAGNETIC RADIATION, 28 2.9 EINSTEIN COEFFICIENTS OF ABSORPTION
AND EMISSION, 31 2.10 ROTATIONAL ENERGIES OF RIGID MOLECULES, 33 2.10.1
SPHERICAL TOP ROTORS, 35 2.10.2 LINEAR MOLECULES, 36 2.10.3 SYMMETRIE
TOP MOLECULES, 36 2.10.4 ROTATIONAL SPECTRA AND SELECTION RULES FOR
LINEAR MOLECULES, 37 2.10.5 ROTATIONAL ENERGIES AND SPECTRA OF SYMMETRIE
TOP ROTORS, 39 2.10.6 ROTATIONAL-VIBRATIONAL SPECTRA, 39 VI CONTENTS
2.11 ANHARMONICITY AND VIBRATIONAL-ROTATIONAL INTERACTION, 43
REFERENCES, 44 3 POLYATOMIC MOLECULES 3.1 THE SEPARATION OF
TRANSLATIONAL AND ROTATIONAL COORDINATES, 46 3.2 CLASSICAL VIBRATIONS IN
MASS-WEIGHTED CARTESIAN COORDINATES, 47 3.3 QUANTUM MECHANICAL TREATMENT
OF THE VIBRATIONS OF POLYATOMIC MOLECULES, 53 3.4 ACCIDENTAL DEGENERACY
AND FERMI RESONANCE, 58 3.5 GROUP FREQUENCIES, 61 3.6 ISOTOPIC
SUBSTITUTION AND THE TELLER-REDLICH PRODUCT RULE, 63 3.7 NORMAL MODE
CALCULATIONS, 65 3.7.1 AIM OF NORMAL MODE ANALYSIS, 65 3.7.2 INTERNAL
COORDINATES, 66 3.7.3 KINETIC AND POTENTIAL ENERGIES IN INTERNAL
COORDINATES, 67 3.7.4 TRANSFORMATION BETWEEN CARTESIAN, INTERNAL, AND
NORMAL COORDINATES, 69 3.7.5 SYMMETRY COORDINATES, 72 3.8 FORCE FIELDS,
72 3.8.1 THE GENERALIZED VALENCE FORCE FIELD (GVFF), 73 3.8.2
UREY-BRADLEY FORCE FIELD (UBFF), 75 3.8.3 AB INITIO FORCE FIELDS, 77 3.9
EXAMPLE FOR THE COMPUTATION OF NORMAL MODES OF VIBRATION, 78 3.10
VIBRATIONAL INTENSITIES: ABSORPTION, 86 REFERENCES, 88 4 SYMMETRY OF
MOLECULAR VIBRATIONS 4.2 GROUP REPRESENTATIONS, 95 4.3 REPRESENTATIONS
OF MOLECULAR VIBRATIONS, 100 4.4 SELECTION RULES TOR NORMAL MODES OF
VIBRATION, 103 4.5 SYMMETRY COORDINATES, 106 REFERENCES, 108 5
INTRODUCTION TO RAMAN SPECTROSCOPY 5.1 GENERAL CONSIDERATIONS, 109 5.2
CLASSICAL DESCRIPTION OF THE RAMAN EFFECT, 112 5.3 THE POLARIZABILITY
TENSOR, 114 5.4 RAMAN SELECTION RULES, 117 5.5 POLARIZATION OF RAMAN
SCATTERING, 118 5.5.1 RAMAN SCATTERING GEOMETRIES AND DEPOLARIZATION
RATIOS FOR RIGHT ANGLE SCATTERING, 124 CONTENTS 5.5.2 FORWARD AND
BACKSCATTERING, 126 5.5.3 COMPUTATION OF RAMAN SCATTERED INTENSITIES,
127 5.6 RESONANCE RAMAN SPECTROSCOPY, 128 5.7 TIME-RESOLVED RESONANCE
RAMAN SPECTROSCOPY, 130 5.8 NONLINEAR RAMAN EFFECTS, 133 5.8.1 COHERENT
ANTI-STOKES-RAMAN SCATTERING (CARS), 135 5.8.2 STIMULATED RAMAN
SCATTERING, 138 5.8.3 INVERSE RAMAN EFFECT, 139 5.8.4 RAMAN-INDUCED KERR
EFFECTS, 140 5.8.5 THE HYPER-RAMAN EFFECT, 140 5.9 SURFACE ENHANCED
RAMAN SCATTERING (SERS), 142 REFERENCES, 143 6 INSTRUMENTATION FOR THE
OBSERVATION OF VIBRATIONAL SPECTRA 145 6.1 DISPERSIVE SYSTEMS, 145 6.1.1
MONOCHROMATORS, 145 6.1.2 LIGHT COLLECTION OPTICS FOR MONOCHROMATORS,
148 6.2 INTERFEROMETRIC METHODS, 148 6.2.1 GENERAL ASPECTS OF FOURIER
TRANSFORM INFRARED SPECTROSCOPY, 149 6.2.2 THE MICHELSON INTERFEROMETER,
149 6.2.3 FOURIER SERIES AND FOURIER TRANSFORM, 152 6.2.4 DISCRETE
FOURIER TRANSFORM AND THE FAST FOURIER TRANSFORM ALGORITHM, 154 6.3
INSTRUMENTATION FOR INFRARED SPECTROSCOPY, 157 6.3.1 GENERAL
EXPERIMENTAL CONSIDERATIONS, 157 6.3.2 DISPERSIVE INFRARED
INSTRUMENTATION, 159 6.3.3 PRINCIPLES OF FT SPECTROMETERS, 162 6.3.4
SAMPLING TECHNIQUES IN INFRARED SPECTROSCOPY, 163 6.3.4.1 TRANSMISSION
SPECTROSCOPY, 163 6.3.4.2 ATTENUATED TOTAL REFLECTION AND DIFFUSE
REFLECTANCE, 164 6.4 INSTRUMENTATION FOR RAMAN SPECTROSCOPY, 166 6.4.1
DISPERSIVE SINGLE DETECTOR RAMAN INSTRUMENTATION, 166 6.4.2 MULTICHANNEL
DISPERSIVE RAMAN SPECTROMETERS, 169 6.4.3 FOURIER TRANSFORM RAMAN
INSTRUMENTATION, 172 6.5 HADAMARD TRANSFORM SPECTROSCOPY, 173
REFERENCES, 174 7 VIBRATIONAL SPECTRA OF SELECTED SMALL MOLECULES 7.1
TRIATOMIC MOLECULES, 176 7.2 TETRATOMIC MOLECULES, 177 7.3 PENTATOMIC
METHANE DERIVATIVES, 179 7.3.1 PENTATOMIC MOLECULES WITH T D SYMMETRY,
180 VIII CONTENTS 7.3.2 PENTATOMIC MOLECULES WITH C 3V SYMMETRY, 183
7.3.3 PENTATOMIC MOLECULES WITH C 2V SYMMETRY, 187 7.3.4 PENTATOMIC LOW
SYMMETRY SPECIES, 188 7.4 ETHANE AND ETHANE DERIVATIVES, 191 7.5 EXAMPLE
OF AN AMINO ACID: ALANINE, 194 7.6 CYCLIC MOLECULES: BENZENE, 198 7.7
OUTLOOK, 202 REFERENCES, 203 8 BIOPHYSICAL APPLICATIONS OF VIBRATIONAL
SPECTROSCOPY 20 4 8.1 PEPTIDE VIBRATIONAL SPECTROSCOPY, 205 8.1.1
VIBRATIONS OF THE PEPTIDE LINKAGE, 208 8.1.2 THE CONFORMATIONAL
SENSITIVITY OF THE AMIDE I AND III MODES, 215 8.2 RESONANCE RAMAN
SPECTROSCOPY OF PEPTIDES AND PROTEINS, 220 8.2.1 UV RESONANCE RAMAN
STUDIES OF THE PEPTIDE - LINKAGE, 220 8.2.2 RESONANCE RAMAN SPECTROSCOPY
OF PROSTHETIC GROUPS, 221 8.2.2.1 HERNE GROUP RESONANCE RAMAN STUDIES,
221 8.2.2.2 HERNE GROUP DYNAMIC STUDIES, 224 8.2.3.3 OTHER PROSTHETIC
GROUPS, 225 8.3 NUCLEIC ACIDS: DNA AND RNA, 226 8.3.1 PHOSPHODIESTER
VIBRATIONS, 229 8.3.2 RIBOSE VIBRATIONS, 230 8.3.3 BASE VIBRATIONS, 230
8.3.4 CONFORMATIONAL STUDIES ON MODEL NUCLEOTIDES, 230 8.4 LIPIDS, 232
REFERENCES, 234 9 VIBRATIONAL OPTICAL ACTIVITY 236 9.1 INFRARED
(VIBRATIONAL) CIRCULAR DICHROISM, 237 9.1.1 PHENOMENOLOGICAL DESCRIPTION
AND BASIC EQUATIONS, 237 9.1.2 OBSERVATION OF VCD, 238 9.2 APPLICATIONS
OF VCD: SMALL MOLECULES, 240 9.3 APPLICATIONS OF VCD: BIOMOLECULES, 243
9.3.1 VCD OF PEPTIDES AND HOMO-OLIGOAMINO ACIDS, 243 9.3.2 VCD OF
PROTEINS, 249 9.3.3 VCD OF CANONICAL NUCLEIC ACID MODELS, 250 9.3.4 VCD
INTENSITY CALCULATIONS FOR D(CG) 5 * D(CG) 5 , 252 9.3.5 VCD OF SMALL
OLIGOMERS, 253 CONTENTS IX 9.4 RAMAN OPTICAL ACTIVITY, 256 9.4.1
PHENOMENOLOGICAL DESCRIPTION, 256 9.4.2 OBSERVATION OF ROA, 258 9.5
APPLICATIONS OF ROA: SMALL MOLECULES, 259 9.6 APPLICATIONS OF ROA:
BIOLOGICAL MOLECULES, 260 REFERENCES, 261 APPENDIX I VIBRATIONAL
FREQUENCIES [CM -1 ] FOR SORNE COMMON GROUPS 262 APPENDIX II REFINED SET
OF UREY*BRADLEY 264 APPENDIX III CHARACTER TABLES FOR CHEMICALLY
IMPORTANT SYMMETRY GROUPS 266 INDEX 279 |
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| isbn | 0471595845 |
| language | English |
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| spelling | Diem, Max Verfasser aut Introduction to modern vibrational spectroscopy Max Diem New York u.a. Wiley 1993 XIII, 285 S. graph. Darst. txt rdacontent n rdamedia nc rdacarrier A Wiley interscience publication Espectroscopia larpcal Spectre de vibration Vibrational spectra Raman-Spektroskopie (DE-588)4176916-8 gnd rswk-swf Schwingungsspektroskopie (DE-588)4128960-2 gnd rswk-swf Schwingungsspektroskopie (DE-588)4128960-2 s DE-604 Raman-Spektroskopie (DE-588)4176916-8 s GBV Datenaustausch application/pdf http://bvbr.bib-bvb.de:8991/F?func=service&doc_library=BVB01&local_base=BVB01&doc_number=006049130&sequence=000001&line_number=0001&func_code=DB_RECORDS&service_type=MEDIA Inhaltsverzeichnis |
| spellingShingle | Diem, Max Introduction to modern vibrational spectroscopy Espectroscopia larpcal Spectre de vibration Vibrational spectra Raman-Spektroskopie (DE-588)4176916-8 gnd Schwingungsspektroskopie (DE-588)4128960-2 gnd |
| subject_GND | (DE-588)4176916-8 (DE-588)4128960-2 |
| title | Introduction to modern vibrational spectroscopy |
| title_auth | Introduction to modern vibrational spectroscopy |
| title_exact_search | Introduction to modern vibrational spectroscopy |
| title_full | Introduction to modern vibrational spectroscopy Max Diem |
| title_fullStr | Introduction to modern vibrational spectroscopy Max Diem |
| title_full_unstemmed | Introduction to modern vibrational spectroscopy Max Diem |
| title_short | Introduction to modern vibrational spectroscopy |
| title_sort | introduction to modern vibrational spectroscopy |
| topic | Espectroscopia larpcal Spectre de vibration Vibrational spectra Raman-Spektroskopie (DE-588)4176916-8 gnd Schwingungsspektroskopie (DE-588)4128960-2 gnd |
| topic_facet | Espectroscopia Spectre de vibration Vibrational spectra Raman-Spektroskopie Schwingungsspektroskopie |
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