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Thiazaphospholidines – a Theoretical Insight on Formation and Chemical Structure
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inferredcites →https://doi.org/10.1002/1521-3749(200106)627:6<1173::aid-zaac1173>3.0.co;2-topenalex-extracted
[1,3,4]Thiazaphospholidine. V
inferredcites →https://doi.org/10.1007/978-3-319-53664-4_22openalex-extracted
Electron Density, Kohn–Sham Frontier Orbitals, and Fukui Functions
inferredcites →https://doi.org/10.1016/j.procs.2013.05.246openalex-extracted
Computational Study of the Chemical Reactivity Properties of the Rhodamine B Molecule
inferredcites →https://doi.org/10.1016/s0065-3276(08)60545-6openalex-extracted
Molecular Orbital Theory of Chemical Reactions
inferredcites →https://doi.org/10.1021/ja00279a008openalex-extracted
The use of global and local molecular parameters for the analysis of the gas-phase basicity of amines
inferredcites →https://doi.org/10.1021/ja002966gopenalex-extracted
Variational Principles for Describing Chemical Reactions. Reactivity Indices Based on the External Potential
inferredcites →https://doi.org/10.1021/ja00326a036openalex-extracted
Density functional approach to the frontier-electron theory of chemical reactivity
inferredcites →https://doi.org/10.1021/ja9924039openalex-extracted
Variational Principles for Describing Chemical Reactions: The Fukui Function and Chemical Hardness Revisited
inferredcites →https://doi.org/10.1021/jp046577aopenalex-extracted
New Dual Descriptor for Chemical Reactivity
inferredcites →https://doi.org/10.1021/jp106883sopenalex-extracted
Tautomerism in 4-Hydroxypyrimidine, S-Methyl-2-thiouracil, and 2-Thiouracil
inferredcites →https://doi.org/10.1063/1.1700523openalex-extracted
A Molecular Orbital Theory of Reactivity in Aromatic Hydrocarbons
inferredcites →https://doi.org/10.1063/1.447964openalex-extracted
Electron density, Kohn–Sham frontier orbitals, and Fukui functions
inferredcites →https://doi.org/10.1063/1.464913openalex-extracted
Density-functional thermochemistry. III. The role of exact exchange
inferredcites →https://doi.org/10.1080/00021369.1988.10869169openalex-extracted
Synthesis and Insecticidal Activity of Oxazaphospholidines, Oxathiaphospholanes, and Thiazaphospholidines
inferredcites →https://doi.org/10.1080/10426509408016387openalex-extracted
[1,3,4]Thiazaphospholidine IV†; [1,3,4]Thiazaphospholidinsulfide und -Oxide, Ethinylaminophosphane
inferredcites →https://doi.org/10.1080/10426509608054832openalex-extracted
Unexpected but Easy Synthesis of a Dihydrophosphadiazaazulene
inferredcites →https://doi.org/10.1103/physreva.38.3098openalex-extracted
Density-functional exchange-energy approximation with correct asymptotic behavior
inferredcites →https://doi.org/10.1142/9789812795847_0001openalex-extracted
A Molecular Orbital Theory of Reactivity in Aromatic Hydrocarbons
inferredcites →https://doi.org/10.1155/2013/850297openalex-extracted
Computational Nutraceutics: Chemical Reactivity Properties of the Flavonoid Naringin by Means of Conceptual DFT
inferredcites →https://doi.org/10.1515/znb-1987-0123openalex-extracted
Ein [1,3,4]Thiazaphospholidin, Darstellung und NMR-Daten / A [1,3,4]Thiazaphospholidine, Preparation and NMR Data
inferredcites →https://doi.org/10.3866/pku.whxb20090332openalex-extracted
Conceptual Density Functional Theory and Some Recent Developments
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