Supplemental material
Molecular Physics
An International Journal at the Interface Between Chemistry and Physics
Volume 117, 2019 - Issue 9-12: Dieter Cremer Memorial Issue
Dieter Cremer Memorial
Molecular dynamics of the intramolecular 1, 3-dipolar ene reaction of a nitrile oxide and an alkene: non-statistical behavior of a reaction involving a diradical intermediateFootnote** Dedicated to the memory of the great theoretician and friend, Dieter Cremer.
, 
&
Zhongyue YangDepartment of Chemistry and Biochemistry, University of California, Los Angeles, CA, USACorrespondence[email protected]
https://orcid.org/0000-0003-0395-6617View further author information
https://orcid.org/0000-0003-0395-6617View further author information & Reprints and Corporate Permissions
Please note: Selecting permissions does not provide access to the full text of the article, please see our help page How do I view content?
To request a reprint or corporate permissions for this article, please click on the relevant link below:
Academic Permissions
Please note: Selecting permissions does not provide access to the full text of the article, please see our help page How do I view content?
Obtain permissions instantly via Rightslink by clicking on the button below:
If you are unable to obtain permissions via Rightslink, please complete and submit this Permissions form. For more information, please visit our Permissions help page.
Related Research Data
Molecular Dynamics of Dimethyldioxirane C–H Oxidation
Source:
American Chemical Society (ACS)
4.9 – Intermolecular 1,3-Dipolar Cycloadditions
Source:
Elsevier
Dynamically concerted and stepwise trajectories of the Cope rearrangement of 1,5-hexadiene
Source:
Elsevier BV
Molecular dynamics of the two-stage mechanism of cyclopentadiene dimerization: concerted or stepwise?
Source:
Elsevier BV
A look at the density functional theory zoo with the advanced GMTKN55 database for general main group thermochemistry, kinetics and noncovalent interactions
Source:
Royal Society of Chemistry (RSC)
Thirty years of density functional theory in computational chemistry: an overview and extensive assessment of 200 density functionals
Source:
Informa UK Limited
Molecular Interactions in Solution: An Overview of Methods Based on Continuous Distributions of the Solvent
Source:
American Chemical Society (ACS)
Peptidotriazoles on solid phase: [1,2,3]-triazoles by regiospecific copper(i)-catalyzed 1,3-dipolar cycloadditions of terminal alkynes to azides.
Source:
American Chemical Society (ACS)
Selenophen-2-yl-Substituted Thiocarbonyl Ylides – at the Borderline of Dipolar and Biradical Reactivity
Source:
Wiley
The first two-step 1,3-dipolar cycloadditions: interception of intermediate
Source:
American Chemical Society (ACS)
1,3-Dipolar Cycloadditions. Past and Future†
Source:
Wiley
Molecular dynamics of the intramolecular 1, 3-dipolar ene reaction of a nitrile oxide and an alkene: non-statistical behavior of a reaction involving a diradical intermediate*
Source:
Taylor & Francis
An exploratory study of reactant vibrational effects in CH3 + H2 and its isotopic variants
Source:
AIP Publishing
Dynamics, transition states, and timing of bond formation in Diels–Alder reactions
Source:
Proceedings of the National Academy of Sciences
Applications of the Linnett electronic theory to organic chemistry. Part III. Linnett structures for 1,3-dipoles and for the diradical intermediates in 1,3-dipolar cycloadditions
Source:
Royal Society of Chemistry (RSC)
Geht der 1.3-Dipolaren cycloaddition eine 1.1 -addition voraus ?
Source:
Elsevier BV
Dynamics of 1,3-dipolar cycloadditions: energy partitioning of reactants and quantitation of synchronicity.
Source:
American Chemical Society (ACS)
1,3-Dipolar cycloadditions. 76. Concerted nature of 1,3-dipolar cycloadditions and the question of diradical intermediates
Source:
American Chemical Society (ACS)
Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density
Source:
American Physical Society (APS)
Intramolecular cycloaddition reactions of diazoalkenes. A theoretical prognosis of nitrene type behavior
Source:
American Chemical Society (ACS)
Mechanism of 1,3-dipolar cycloadditions
Source:
American Chemical Society (ACS)
1,3-Dipolar cycloaddition of chalcones and arylidene-1,3-dicarbonyls with diazosulfone for the regioselective synthesis of functionalized pyrazoles and pyrazolines
Source:
Elsevier BV
Density-functional thermochemistry. I. The effect of the exchange-only gradient correction
Source:
AIP Publishing
Linking provided by
