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Some Intrinsic Features of Hydroxylamines, Oximes and Hydroxamic Acids: Integration of Theory and Experiment

Hydroxylamines, Oximes and Hydroxamic Acids (2008)

  1. Peter Politzer1,
  2. Jane S. Murray2

Published Online: 15 APR 2010

DOI: 10.1002/9780470682531.pat0453

Patai's Chemistry of Functional Groups

Patai's Chemistry of Functional Groups

How to Cite

Politzer, P. and Murray, J. S. 2010. Some Intrinsic Features of Hydroxylamines, Oximes and Hydroxamic Acids: Integration of Theory and Experiment. Patai's Chemistry of Functional Groups. .

Author Information

  1. 1

    University of New Orleans, Department of Chemistry, New Orleans, LA, USA

  2. 2

    Cleveland State University, Department of Chemistry, Cleveland, OH, USA

Publication History

  1. Published Online: 15 APR 2010

Abstract

  • 1
    Introduction
  • 2
    Analysis of Covalent and Noncovalent Interactions
  • 3
    Computational Approach
  • 4
    Lone Pair–Lone Pair Repulsion
  • 5
    Comparison of Prototypical Examples
  • 6
    Oxime Isomerism
  • 7
    Hydrogen Bonding
  • 8
    Acidity/Basicity
  • 9
    Global and Local Polarizability
  • 10
    Conclusion
  • 11
    Acknowledgment

Keywords:

  • intrinsic features of hydroxylamines, oximes and hydroxamic acids-theory and experiment;
  • covalent and noncovalent interaction analysis;
  • ionization energy;
  • surface electrostatic potential, and its most positive and most negative values;
  • lone pair–lone pair repulsion;
  • computational approach;
  • hydroxylamines, oximes and hydroxamic acids-with adjacent nitrogen and oxygen atoms;
  • oxime isomerism

Featured Compounds

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  1. 1 - 14
Compound 1
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 2
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Molecular Formula:Not Available
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Compound 3
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Compound 9B
Molecular Weight:Not Available
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Compound 10A
Molecular Weight:Not Available
Molecular Formula:Not Available
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Compound 10B
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 8
Molecular Weight:75.0666
Molecular Formula:C2H5NO2
InChIKey:RRUDCFGSUDOHDG-UHFFFAOYSA-N
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Compound 6
Molecular Weight:61.0831
Molecular Formula:C2H7NO
InChIKey:VMESOKCXSYNAKD-UHFFFAOYSA-N
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Compound 7
Molecular Weight:73.0938
Molecular Formula:C3H7NO
InChIKey:PXAJQJMDEXJWFB-UHFFFAOYSA-N
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Compound 9A
Molecular Weight:Not Available
Molecular Formula:Not Available
InChIKey:Not Available
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Compound 9
Molecular Weight:59.0672
Molecular Formula:C2H5NO
InChIKey:FZENGILVLUJGJX-NSCUHMNNSA-N
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Compound 10
Molecular Weight:135.1632
Molecular Formula:C8H9NO
InChIKey:JHNRZXQVBKRYKN-CLFYSBASSA-N
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Compound 11
Molecular Weight:86.0495
Molecular Formula:C2H2N2O2
InChIKey:RQCAREAVVCFQHW-UHFFFAOYSA-N
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Compound 12
Molecular Weight:116.1185
Molecular Formula:C4H8N2O2
InChIKey:JGUQDUKBUKFFRO-GGWOSOGESA-N
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