Literature DB >> 28872872

Nucleus-Independent Chemical Shifts:  A Simple and Efficient Aromaticity Probe.

Paul von Ragué Schleyer1, Christoph Maerker1, Alk Dransfeld1, Haijun Jiao1, Nicolaas J R van Eikema Hommes1.   

Abstract

Year:  1996        PMID: 28872872     DOI: 10.1021/ja960582d

Source DB:  PubMed          Journal:  J Am Chem Soc        ISSN: 0002-7863            Impact factor:   15.419


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  234 in total

1.  Ab initio molecular orbital and density functional studies on the ring-opening reaction of oxetene.

Authors:  S Jayaprakash; Jebakumar Jeevanandam; K Subramani
Journal:  J Mol Model       Date:  2014-11-05       Impact factor: 1.810

2.  Theoretical studies on all-metal binuclear sandwich-like complexes M2(η 4-E 4) 2 (M=Al, Ga, In; E=Sb, Bi).

Authors:  Congzhi Wang; Xiuhui Zhang; Jian Lu; Qianshu Li
Journal:  J Mol Model       Date:  2012-02-16       Impact factor: 1.810

3.  Active components of frequently used β-blockers from the aspect of computational study.

Authors:  Stevan Armaković; Sanja J Armaković; Jovan P Setrajčić; Igor J Setrajčić
Journal:  J Mol Model       Date:  2012-05-29       Impact factor: 1.810

4.  Theoretical study of structure, bonding, and electronic behavior of novel sandwich compounds M₃(C6R6)₂ (M = Ni, Pd, Pt; R = H, F).

Authors:  Ke Zhou
Journal:  J Mol Model       Date:  2012-05-31       Impact factor: 1.810

5.  A MP2 and DFT study of the aromatic character of polyphosphaphospholes. Is the pyramidality the only factor to take into consideration?

Authors:  Daniela Josa; Angeles Peña-Gallego; Jesús Rodríguez-Otero; Enrique M Cabaleiro-Lago
Journal:  J Mol Model       Date:  2010-09-02       Impact factor: 1.810

6.  Sigma- and pi- electron structure of aza-azoles.

Authors:  Tadeusz M Krygowski; Wojciech P Oziminski; Christopher A Ramsden
Journal:  J Mol Model       Date:  2010-09-17       Impact factor: 1.810

7.  Analysis of anisotropic effects in trinuclear metal carbonyl compounds by visualization of through-space NMR shielding.

Authors:  Martha T de Araujo; Eluzir P Chacon; José W de M Carneiro; Andreas Koch; Erich Kleinpeter
Journal:  J Mol Model       Date:  2010-02-17       Impact factor: 1.810

8.  A study of the aromaticity of heteroannelated cyclooctatetraene derivatives.

Authors:  Ablimit Abdukadir; Aygul Mattursun; Ablikim Kerim; Kamalbek Omar; Lutpulla Hushur
Journal:  J Mol Model       Date:  2018-05-02       Impact factor: 1.810

9.  The formation of endo-complexes between calixarenes and amines--a reinvestigation.

Authors:  Ralph Puchta; Timothy Clark; Walter Bauer
Journal:  J Mol Model       Date:  2006-04-01       Impact factor: 1.810

10.  Computational quest for spherical C12B68 fullerenes with "magic" π-electrons and quasi-planar tetra-coordinated carbon.

Authors:  Fengyu Li; De-en Jiang; Zhongfang Chen
Journal:  J Mol Model       Date:  2014-02-14       Impact factor: 1.810

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