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Title of Journal: J Struct Chem

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Abbravation: Journal of Structural Chemistry

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Springer US

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DOI

10.1007/s11434-010-4031-5

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ISSN

1573-8779

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Emphasis Type="Italic"Ab initio/Emphasis quant

Authors: E Yu Larionova N M Vitkovksaya V B Kobychev N B Caempf B A Trofimov
Publish Date: 2008/09/14
Volume: 49, Issue: 4, Pages: 595-599
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Abstract

The profile of the reaction CH3OH + MOH ā†’ CH3OM + H2O in the presence of an alkali MOH M = Li Na K was investigated by the ab initio quantumchemical method for the gas phase with allowance for the solvent within the continuum model The proton transfer and the formation of the alkaline methoxide molecule in MOH/DMSO/CH3OH systems M = Li Na K in the alkalimethanol prereaction complexes can take place without their preliminary dissociation and are barrierfree reactions

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  1. Inverse problem in XANES theory
  2. Crystal structure and fluorescence of a new 2D layered cadmium(II) malate coordination polymer
  3. Crystal structure of ammonium pentachloroaquaruthenate(III) (NH 4 ) 2 [Ru(H 2 O)Cl 5 ]
  4. Structure of the surface layer of mercury and adhesion of Langmuir monolayers on it
  5. Microwave spectrum, centrifugal perturbation, dipole moment, and conformation of 5-methyl-1,3-dioxane
  6. Structural thermodynamic characteristics and intermolecular interactions in aqueous solutions of hexamethylphosphorotriamide
  7. Crystal And Molecular Structure of Zinc DI-(4-Chlorphenylthioacetate) Dihydrate
  8. Crystal structure of a two-dimensional Co(II) coordination polymer: [Co(Ī¼-PP) 2 (SCN) 2 ] n [PP = 2-(pyridine-3-yloxy)pyrazine]
  9. Method for evaluating the probability of structural isomer-isomer transformations with large numbers of quasidegenerations of the energy levels of the interactant subsystems
  10. Structural characterization of dichloridobis( N,Nā€™ -dimethylthiourea- S )cadmium(II)
  11. Refinement of LiFe 5 O 8 crystal structure
  12. Theoretical study of the conformational structure and thermodynamic properties of 5-(4-oxo-1,3-thiazolidine-2-ylidene)-rhodanine and ethyl-5-(4-oxo-1,3-thiazolidine-2-ylidene)-rhodanine-3-acetic acid as acceptor groups of indoline dyes
  13. Crystal Structure of Iridium(III) trans -Trifluoroacetylacetonate
  14. Study of the properties and structure of nanosize membranes for acousto-optic devices
  15. Micellar synthesis and characterization of ultradispersed powders of ammonium nitrate
  16. The product of thermobaric treatment of Pt 0.25 Os 0.75
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