Schleyer Pv - Search Results

1

Bonding, aromaticity, and planar tetracoordinated carbon in Si2CH 2 and Ge 2CH 2.

Vogt-Geisse S, Wu JI, Schleyer Pv, Schaefer HF 3rd. Vogt-Geisse S, et al. Among authors: schleyer pv. J Mol Model. 2015 Aug;21(8):217. doi: 10.1007/s00894-015-2736-8. Epub 2015 Aug 1. J Mol Model. 2015. PMID: 26232183

2

Aromaticity evaluations of planar [6]radialenes.

Berionni G, Wu JI, Schleyer PV. Berionni G, et al. Among authors: schleyer pv. Org Lett. 2014 Dec 5;16(23):6116-9. doi: 10.1021/ol5029699. Epub 2014 Nov 19. Org Lett. 2014. PMID: 25409485

3

Description of aromaticity in porphyrinoids.

Wu JI, Fernández I, Schleyer Pv. Wu JI, et al. Among authors: schleyer pv. J Am Chem Soc. 2013 Jan 9;135(1):315-21. doi: 10.1021/ja309434t. Epub 2012 Dec 21. J Am Chem Soc. 2013. PMID: 23205604

4

Free Cyclooctatetraene Dianion: Planarity, Aromaticity, and Theoretical Challenges.

Sokolov AY, Magers DB, Wu JI, Allen WD, Schleyer PV, Schaefer HF 3rd. Sokolov AY, et al. Among authors: schleyer pv. J Chem Theory Comput. 2013 Oct 8;9(10):4436-43. doi: 10.1021/ct400642y. Epub 2013 Sep 17. J Chem Theory Comput. 2013. PMID: 26589161 No abstract available.

5

Ab initio study of the geometry, stability, and aromaticity of the cyclic S2N3(+) cation isomers and their isoelectronic analogues.

Zhang GH, Zhao YF, Wu JI, Schleyer PV. Zhang GH, et al. Among authors: schleyer pv. Inorg Chem. 2009 Jul 20;48(14):6773-80. doi: 10.1021/ic900718t. Inorg Chem. 2009. PMID: 19496559

6

The 4,5,6-triphospha[3]radialene dianion: a phosphorus analogue of the deltate dianion. A NICS(0)(πzz) examination of their aromaticity.

Miyake H, Sasamori T, Wu JI, Schleyer Pv, Tokitoh N. Miyake H, et al. Among authors: schleyer pv. Chem Commun (Camb). 2012 Dec 4;48(93):11440-2. doi: 10.1039/c2cc35978b. Epub 2012 Oct 22. Chem Commun (Camb). 2012. PMID: 23090183

7

SASS: a symmetry adapted stochastic search algorithm exploiting site symmetry.

Wheeler SE, Schleyer PV, Schaefer HF. Wheeler SE, et al. Among authors: schleyer pv. J Chem Phys. 2007 Mar 14;126(10):104104. doi: 10.1063/1.2646940. J Chem Phys. 2007. PMID: 17362058

8

Towards graphite: magnetic properties of large polybenzenoid hydrocarbons.

Moran D, Stahl F, Bettinger HF, Schaefer HF 3rd, Schleyer P. Moran D, et al. J Am Chem Soc. 2003 Jun 4;125(22):6746-52. doi: 10.1021/ja034497z. J Am Chem Soc. 2003. PMID: 12769585

9

The peculiar trend of cyclic perfluoroalkane electron affinities with increasing ring size.

Paul A, Wannere CS, Kasalova V, Schleyer Pv, Schaefer HF 3rd. Paul A, et al. Among authors: schleyer pv. J Am Chem Soc. 2005 Nov 9;127(44):15457-69. doi: 10.1021/ja053310w. J Am Chem Soc. 2005. PMID: 16262410

10

Carbene stabilization by aryl substituents. Is bigger better?

Woodcock HL, Moran D, Brooks BR, Schleyer PV, Schaefer HF 3rd. Woodcock HL, et al. Among authors: schleyer pv. J Am Chem Soc. 2007 Mar 28;129(12):3763-70. doi: 10.1021/ja068899t. Epub 2007 Feb 28. J Am Chem Soc. 2007. PMID: 17326641

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