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Items: 1 to 20 of 92

1.

Conjugate Addition/[3,3] Sigmatropic Shift Processes for Formation of Medium-Ring Cyclic Amines - Do They Circumvent the Woodward-Hoffmann Rules?

Painter PP, Siebert MR, Tantillo DJ.

J Org Chem. 2015 Dec 4;80(23):11699-705. doi: 10.1021/acs.joc.5b00996. Epub 2015 Jul 24.

PMID:
26168077
2.

Competitive Pseudopericyclic [3,3]- and [3,5]-Sigmatropic Rearrangements of Trichloroacetimidates.

Sharma S, Rajale T, Unruh DK, Birney DM.

J Org Chem. 2015 Dec 4;80(23):11734-43. doi: 10.1021/acs.joc.5b01355. Epub 2015 Aug 20.

PMID:
26270026
3.

N[1,3]-Sigmatropic shift in the benzidine rearrangement: experimental and theoretical investigation.

Hou S, Li X, Xu J.

Org Biomol Chem. 2014 Jul 21;12(27):4952-63. doi: 10.1039/c4ob00080c.

PMID:
24879467
5.

The Woodward-Hoffmann rules reinterpreted by conceptual density functional theory.

Geerlings P, Ayers PW, Toro-Labbé A, Chattaraj PK, De Proft F.

Acc Chem Res. 2012 May 15;45(5):683-95. doi: 10.1021/ar200192t. Epub 2012 Jan 27.

PMID:
22283422
6.

Should the Woodward-Hoffmann Rules be Applied to Mechanochemical Reactions?

Wollenhaupt M, Krupička M, Marx D.

Chemphyschem. 2015 Jun 8;16(8):1593-7. doi: 10.1002/cphc.201500054. Epub 2015 Feb 16.

PMID:
25689065
7.

Mechanistic insight into the formal [1,3]-migration in the thermal Claisen rearrangement.

Hou S, Li X, Xu J.

J Org Chem. 2012 Dec 7;77(23):10856-69. doi: 10.1021/jo302210t. Epub 2012 Nov 20.

PMID:
23150994
8.

Woodward-Hoffmann rules in density functional theory: initial hardness response.

De Proft F, Ayers PW, Fias S, Geerlings P.

J Chem Phys. 2006 Dec 7;125(21):214101.

PMID:
17166009
9.

Initial Hardness Response and Hardness Profiles in the Study of Woodward-Hoffmann Rules for Electrocyclizations.

De Proft F, Chattaraj PK, Ayers PW, Torrent-Sucarrat M, Elango M, Subramanian V, Giri S, Geerlings P.

J Chem Theory Comput. 2008 Apr;4(4):595-602. doi: 10.1021/ct700289p.

PMID:
26620934
10.

Electrocyclic ring opening of cis-bicyclo[m.n.0]alkenes: the anti-Woodward-Hoffmann quest.

Silva López C, Nieto Faza O, de Lera AR.

Chemistry. 2007;13(17):5009-17.

PMID:
17372999
11.

Sigmatropic proton shifts: a quantum chemical study.

Wang Y, Yu ZX.

Org Biomol Chem. 2017 Sep 13;15(35):7439-7446. doi: 10.1039/c7ob01628j.

PMID:
28832696
12.

Conservation of orbital symmetry can be circumvented in mechanically induced reactions.

Friedrichs J, Lüssmann M, Frank I.

Chemphyschem. 2010 Oct 25;11(15):3339-42. doi: 10.1002/cphc.201000460.

PMID:
20821794
13.

Understanding the Woodward-Hoffmann rules by using changes in electron density.

Ayers PW, Morell C, De Proft F, Geerlings P.

Chemistry. 2007;13(29):8240-7.

PMID:
17639522
14.

Evidence for a Sigmatropic and an Ionic Pathway in the Winstein Rearrangement.

Ott AA, Packard MH, Ortuño MA, Johnson A, Suding VP, Cramer CJ, Topczewski JJ.

J Org Chem. 2018 Aug 3;83(15):8214-8224. doi: 10.1021/acs.joc.8b00961. Epub 2018 Jun 14.

PMID:
29870252
15.

Towards thermally stable cyclophanediene-dihydropyrene photoswitches.

Khan N, Sheikh NS, Khan AF, Ludwig R, Mahmood T, Rehman W, Al-Faiyz YS, Ayub K.

J Mol Model. 2015 Jun;21(6):148. doi: 10.1007/s00894-015-2695-0. Epub 2015 May 20.

PMID:
25986774
16.

A FMO-controlled reaction path in the benzil-benzilic acid rearrangement.

Yamabe S, Tsuchida N, Yamazaki S.

J Org Chem. 2006 Mar 3;71(5):1777-83.

PMID:
16496961
17.

Reactivity-Structure-Based Rate Estimation Rules for Alkyl Radical H Atom Shift and Alkenyl Radical Cycloaddition Reactions.

Wang K, Villano SM, Dean AM.

J Phys Chem A. 2015 Jul 16;119(28):7205-21. doi: 10.1021/jp511017z. Epub 2015 Jan 26.

PMID:
25563061
18.

Cethrene: The Chameleon of Woodward-Hoffmann Rules.

Šolomek T, Ravat P, Mou Z, Kertesz M, Juríček M.

J Org Chem. 2018 Apr 20;83(8):4769-4774. doi: 10.1021/acs.joc.8b00656. Epub 2018 Apr 2.

PMID:
29554426
19.

Activation energies of sigmatropic shifts in propene and acetone enolate from the anti-Hermitian contracted Schrödinger equation.

Foley JJ 4th, Rothman AE, Mazziotti DA.

J Chem Phys. 2009 May 14;130(18):184112. doi: 10.1063/1.3129922.

PMID:
19449913
20.

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