Chemical Bonding in Hypervalent Molecules Revised. 2.†Application of the Atoms in Molecules Theory to Y2XZ and Y2XZ2(Y = H, F, CH3; X = O, S, Se; Z = O, S) Compounds

J. A. Dobado; Henar Martínez-García;  Molina; Markku R. Sundberg

doi:10.1021/ja9828206

Chemical Bonding in Hypervalent Molecules Revised. 2.†Application of the Atoms in Molecules Theory to Y2XZ and Y2XZ2(Y = H, F, CH3; X = O, S, Se; Z = O, S) Compounds

Journal of the American Chemical Society ◽

10.1021/ja9828206 ◽

1999 ◽

Vol 121 (13) ◽

pp. 3156-3164 ◽

Cited By ~ 43

Author(s):

J. A. Dobado ◽

Henar Martínez-García ◽

Molina ◽

Markku R. Sundberg

Keyword(s):

Chemical Bonding ◽

Atoms In Molecules ◽

Hypervalent Molecules ◽

Atoms In Molecules Theory

Download Full-text

Chemical Bonding in Hypervalent Molecules Revised. 3.†Application of the Atoms in Molecules Theory to Y3X−CH2(X = N, P, or As; Y = H or F) and H2X−CH2(X = O, S, or Se) Ylides

Journal of the American Chemical Society ◽

10.1021/ja992672z ◽

2000 ◽

Vol 122 (6) ◽

pp. 1144-1149 ◽

Cited By ~ 67

Author(s):

J. A. Dobado ◽

Henar Martínez-García ◽

Molina ◽

Markku R. Sundberg

Keyword(s):

Chemical Bonding ◽

Atoms In Molecules ◽

Hypervalent Molecules ◽

Atoms In Molecules Theory

Download Full-text

ChemInform Abstract: Atomic Energy in the “Atoms in Molecules” Theory and Its Use for Solving Chemical Problems

ChemInform ◽

10.1002/chin.200944273 ◽

2009 ◽

Vol 40 (44) ◽

Author(s):

I. S. Bushmarinov ◽

K. A. Lyssenko ◽

M. Yu. Antipin

Keyword(s):

Atomic Energy ◽

Atoms In Molecules ◽

Atoms In Molecules Theory

Download Full-text

Chemical Bonding in Hypervalent Molecules: Is the Octet Rule Relevant?

Inorganic Chemistry ◽

10.1021/ic011003v ◽

2002 ◽

Vol 41 (8) ◽

pp. 2164-2172 ◽

Cited By ~ 81

Author(s):

Stéphane Noury ◽

Bernard Silvi ◽

Ronald J. Gillespie

Keyword(s):

Chemical Bonding ◽

Hypervalent Molecules ◽

Octet Rule

Download Full-text

The Quantum Theory of Atoms in Molecules and the Interactive Conception of Chemical Bonding

Philosophy of Science ◽

10.1086/705448 ◽

2019 ◽

Vol 86 (5) ◽

pp. 1307-1317

Author(s):

Stephen Esser

Keyword(s):

Quantum Theory ◽

Chemical Bonding ◽

Atoms In Molecules

Download Full-text

An implementation of the atoms in molecules theory to the FPLAPW method

Computer Physics Communications ◽

10.1016/s0010-4655(01)00428-3 ◽

2002 ◽

Vol 143 (3) ◽

pp. 199-212 ◽

Cited By ~ 13

Author(s):

Yosslen Aray ◽

Jesus Rodriguez ◽

David Vega

Keyword(s):

Atoms In Molecules ◽

Atoms In Molecules Theory

Download Full-text

Atoms in molecules theory for exploring the nature of the MoS2 catalyst edges sites

Journal of Molecular Catalysis A Chemical ◽

10.1016/j.molcata.2006.09.034 ◽

2007 ◽

Vol 265 (1-2) ◽

pp. 32-41 ◽

Cited By ~ 11

Author(s):

Yosslen Aray ◽

Jesus Rodríguez

Keyword(s):

Atoms In Molecules ◽

Atoms In Molecules Theory ◽

Mos2 Catalyst

Download Full-text

Atoms in Molecules Theory for Exploring the Nature of the Active Sites on Surfaces

The Quantum Theory of Atoms in Molecules ◽

10.1002/9783527610709.ch9 ◽

2007 ◽

pp. 231-256 ◽

Cited By ~ 2

Author(s):

Yosslen Aray ◽

Jesus Rodrguez ◽

David Vega

Keyword(s):

Active Sites ◽

Atoms In Molecules ◽

Atoms In Molecules Theory

Download Full-text

An Atoms-in-Molecules Theory Interpretation for the Structure of Di-n-Butyltin(IV) Derivative of Glycylvaline

National Academy Science Letters ◽

10.1007/s40009-018-0756-5 ◽

2019 ◽

Vol 42 (4) ◽

pp. 327-331

Author(s):

Sandeep Pokharia ◽

Swatantra Kumar Yadav ◽

Hirdyesh Mishra

Keyword(s):

Atoms In Molecules ◽

Atoms In Molecules Theory ◽

Theory Interpretation

Download Full-text

Nature of Transannular Intramolecular Interactions in Group 4 and 6 Metallatranes: A Combined Density Functional Theory and Atoms in Molecules Theory Study

Inorganic Chemistry ◽

10.1021/ic101542m ◽

2010 ◽

Vol 49 (21) ◽

pp. 9884-9890 ◽

Cited By ~ 4

Author(s):

Ashwini K. Phukan ◽

Ankur Kanti Guha

Keyword(s):

Density Functional Theory ◽

Density Functional ◽

Intramolecular Interactions ◽

Atoms In Molecules ◽

Functional Theory ◽

Group 4 ◽

Atoms In Molecules Theory

Download Full-text

Hydrogen–Hydrogen Bonding in Planar Biphenyl, Predicted by Atoms-In-Molecules Theory, Does Not Exist

Chemistry - A European Journal ◽

10.1002/chem.200500850 ◽

2006 ◽

Vol 12 (10) ◽

pp. 2889-2895 ◽

Cited By ~ 240

Author(s):

Jordi Poater ◽

Miquel Solà ◽

F. Matthias Bickelhaupt

Keyword(s):

Hydrogen Bonding ◽

Atoms In Molecules ◽

Atoms In Molecules Theory

Download Full-text