Literature DB >> 17915847

Stability, reactivity, and aromaticity of compounds of a multivalent superatom.

Pratim Kumar Chattaraj1, Santanab Giri.   

Abstract

In this article, we analyze the stability, reactivity, and possible aromatic behavior of two recently reported clusters (Reveles, J. U.; Khanna, S. N.; Roach, P. J.; Castleman, A. W., Jr. Proc. Natl. Acad. Sci. 2006, 103, 18405), viz., Al(7)C(-) and Al(7)O(-) in the light of the principles of the maximum hardness and minimum electrophilicity as well as the nucleus-independent chemical shift values. Stability of these clusters in the context of addition/removal of an electron or an Al atom is now clearly understood.

Entities:  

Year:  2007        PMID： 17915847     DOI： 10.1021/jp0760758

Source DB:  PubMed          Journal:  J Phys Chem A        ISSN： 1089-5639            Impact factor:   2.781


  6 in total

1.  Reaction between CH2 and HCCN: a theoretical approach to acrylonitrile formation in the interstellar medium.

Authors:  Alka Misra; Poonam Tandon
Journal:  Orig Life Evol Biosph       Date:  2014-11-22       Impact factor: 1.950

2.  A systematic computational study of acridine derivatives through conceptual density functional theory.

Authors:  Prabhat Ranjan; Brotati Chakraborty; Tanmoy Chakraborty
Journal:  Mol Divers       Date:  2022-07-04       Impact factor: 2.943

Review 3.  Conceptual density functional theory based electronic structure principles.

Authors:  Debdutta Chakraborty; Pratim Kumar Chattaraj
Journal:  Chem Sci       Date:  2021-03-31       Impact factor: 9.825

4.  Computational Identification of Druggable Bioactive Compounds from Catharanthus roseus and Avicennia marina against Colorectal Cancer by Targeting Thymidylate Synthase.

Authors:  Md Rashedul Islam; Md Abdul Awal; Ahmed Khames; Mohammad A S Abourehab; Abdus Samad; Walid M I Hassan; Rahat Alam; Osman I Osman; Suza Mohammad Nur; Mohammad Habibur Rahman Molla; Abdulrasheed O Abdulrahman; Sultana Rajia; Foysal Ahammad; Md Nazmul Hasan; Ishtiaq Qadri; Bonglee Kim
Journal:  Molecules       Date:  2022-03-24       Impact factor: 4.411

5.  Synthesis, spectral analysis, quantum studies, NLO, and thermodynamic properties of the novel 5-(6-hydroxy-4-methoxy-1-benzofuran-5-ylcarbonyl)-6-amino-3-methyl-1H-pyrazolo[3,4-b] pyridine (HMBPP).

Authors:  Shimaa Abdel Halim; Magdy A Ibrahim
Journal:  RSC Adv       Date:  2022-04-29       Impact factor: 4.036

6.  Size engineering optoelectronic features of C, Si and CSi hybrid diamond-shaped quantum dots.

Authors:  H Ouarrad; F-Z Ramadan; L B Drissi
Journal:  RSC Adv       Date:  2019-09-11       Impact factor: 4.036
  6 in total

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