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A THEORETICAL STUDY OF SUBSTITUTED CHNO ISOMERS.

Author
POPPINGER D; RADOM L
RES. SCH. CHEM., AUST. NATL. UNIV., CANBERRA, A.C.T. 2600, AUST.
Source
J. AMER. CHEM. SOC.; USA; DA. 1978; VOL. 100; NO 12; PP. 3674-3685; BIBL. 54 REF.
Document type
Article
Language
English
Keyword (fr)
ISOCYANATE ISOCYANATE ORGANIQUE CYANATE CYANATE ORGANIQUE FULMINATE FULMINATE ORGANIQUE NITRENE NITRILE HETEROCYCLE OXYGENE AZOTE HETEROCYCLE INSATURE COMPOSE MONOCYCLIQUE CYCLE 2 HETEROATOMES CONFORMATION STABILITE EFFET SUBSTITUANT ENERGIE TOTALE ENERGIE LIAISON ETUDE THEORIQUE METHODE AB INITIO ORBITALE GAUSSIENNE DIMENSION BASE METHODE MO ISOMERISATION DISTRIBUTION CHARGE ELECTRONIQUE MOMENT DIPOLAIRE OXAZIRINE DERIVE NITRILE OXYDE COMPOSE MINERAL COMPOSE ORGANIQUE PHYSIQUE MOLECULAIRE PHYSIQUE ATOMIQUE
Keyword (en)
ISOCYANATES ORGANIC ISOCYANATE CYANATES ORGANIC CYANATE FULMINATES ORGANIC FULMINATE NITRENE NITRILE OXYGEN NITROGEN HETEROCYCLE UNSATURATED HETEROCYCLE MONOCYCLIC COMPOUND CONFORMATION STABILITY SUBSTITUENT EFFECT TOTAL ENERGY BINDING ENERGY THEORETICAL STUDY AB INITIO METHOD GAUSSIAN ORBITAL BASIS SET SIZE MO METHOD ISOMERIZATION ELECTRON CHARGE DISTRIBUTION DIPOLE MOMENT NITRILE OXIDE INORGANIC COMPOUND ORGANIC COMPOUNDS MOLECULAR PHYSICS ATOMIC PHYSICS
Keyword (es)
FISICA MOLECULAR FISICA ATOMICA
Classification
Pascal
001 Exact sciences and technology / 001B Physics / 001B30 Atomic and molecular physics

Discipline
Atomic and molecular physics
Origin
Inist-CNRS
Database
PASCAL
INIST identifier
PASCAL7940015590

Sauf mention contraire ci-dessus, le contenu de cette notice bibliographique peut être utilisé dans le cadre d’une licence CC BY 4.0 Inist-CNRS / Unless otherwise stated above, the content of this bibliographic record may be used under a CC BY 4.0 licence by Inist-CNRS / A menos que se haya señalado antes, el contenido de este registro bibliográfico puede ser utilizado al amparo de una licencia CC BY 4.0 Inist-CNRS

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