Related references
Note: Only part of the references are listed.The activation strain model of chemical reactivity
Willem-Jan van Zeist et al.
ORGANIC & BIOMOLECULAR CHEMISTRY (2010)
Double Group Transfer Reactions: Role of Activation Strain and Aromaticity in Reaction Barriers
Israel Fernandez et al.
CHEMISTRY-A EUROPEAN JOURNAL (2009)
The Steric Nature of the Bite Angle
Willem-Jan van Zeist et al.
CHEMISTRY-A EUROPEAN JOURNAL (2009)
The Interplay between Steric and Electronic Effects in S(N)2 Reactions
Israel Fernandez et al.
CHEMISTRY-A EUROPEAN JOURNAL (2009)
The Nature of the Metal-Carbene Bond in Normal and Abnormal Pyridylidene, Quinolylidene and Isoquinolylidene Complexes
Greta Heydenrych et al.
EUROPEAN JOURNAL OF INORGANIC CHEMISTRY (2009)
Twelve One-Electron Ligands Coordinating One Metal Center: Structure and Bonding of [Mo(ZnCH3)(9)(ZnCp*)(3)]
Thomas Cadenbach et al.
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2008)
Nucleophilicity and leaving-group ability in frontside and backside SN2 reactions
A. Patricia Bento et al.
JOURNAL OF ORGANIC CHEMISTRY (2008)
Aromaticity and Antiaromaticity in 4-, 6-, 8-, and 10-Membered Conjugated Hydrocarbon Rings
Simon C. A. H. Pierrefixe et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2008)
The strength of the σ-, π- and δ-bonds in Re2Cl82-
Andreas Krapp et al.
THEORETICAL CHEMISTRY ACCOUNTS (2008)
Multimetallocenes.: A theoretical study
Alejandro Velazquez et al.
ORGANOMETALLICS (2007)
Transition-state energy and position along the reaction coordinate in an extended activation strain model
G. Theodoor de Jong et al.
CHEMPHYSCHEM (2007)
Unicorns in the world of chemical bonding models
Gernot Frenking et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2007)
Is my chemical universe localized or delocalized? Is there a future for chemical concepts?
Sason Shaik
NEW JOURNAL OF CHEMISTRY (2007)
Aromaticity: Molecular-orbital picture of an intuitive concept
Simon C. A. H. Pierrefixe et al.
CHEMISTRY-A EUROPEAN JOURNAL (2007)
Aromaticity in metallabenzenes
Israel Fernandez et al.
CHEMISTRY-A EUROPEAN JOURNAL (2007)
Direct estimate of conjugation and aromaticity in cyclic compounds with the EDA method
Israel Fernandez et al.
FARADAY DISCUSSIONS (2007)
Bonding analysis of N-heterocyclic carbene tautomers and phosphine Ligands in transition-metal complexes: A theoretical study
Ralf Tonner et al.
CHEMISTRY-AN ASIAN JOURNAL (2007)
Catalytic carbon-halogen bond activation: Trends in reactivity, selectivity, and solvation
G. Theodoor de Jong et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2007)
Orbital overlap and chemical bonding
Andreas Krapp et al.
CHEMISTRY-A EUROPEAN JOURNAL (2006)
Semiempirical GGA-type density functional constructed with a long-range dispersion correction
Stefan Grimme
JOURNAL OF COMPUTATIONAL CHEMISTRY (2006)
Oxidative addition to main group versus transition metals: Insights from the Activation Strain model
G. Theodoor de Jong et al.
JOURNAL OF ORGANOMETALLIC CHEMISTRY (2006)
Oxidative addition versus dehydrogenation of methane, silane, and heavier AH4 congeners reacting with palladium
Joost N. P. van Stralen et al.
ORGANOMETALLICS (2006)
The Pb122- and Pb102- zintl ions and the M@Pb122- and M@Pb102- cluster series where M = Ni, Pd, Pt
Emren N. Esenturk et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2006)
Direct estimate of the strength of conjugation and hyperconjugation by the energy decomposition analysis method
I Fernández et al.
CHEMISTRY-A EUROPEAN JOURNAL (2006)
An energetic measure of aromaticity and antiaromaticity based on the Pauling-Wheland resonance energies
YR Mo et al.
CHEMISTRY-A EUROPEAN JOURNAL (2006)
Why do the heavy-atom analogues of acetylene E2H2 (E = Si-Pb) exhibit unusual structures?
M Lein et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2005)
Activation of C-H, C-C and C-I bonds by Pd and cis-Pd(CO)2I2• catalyst-substrate adaptation
A Diefenbach et al.
JOURNAL OF ORGANOMETALLIC CHEMISTRY (2005)
The nature of the chemical bond revisited:: An energy-partitioning analysis of nonpolar bonds
A Kovács et al.
CHEMISTRY-A EUROPEAN JOURNAL (2005)
Activation of H-H, C-H, C-C and C-Cl bonds by Pd and PdCl-.: Understanding anion assistance in C-X bond activation
A Diefenbach et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2005)
Direct estimate of the conjugative and hyperconjugative stabilization in diynes, dienes, and related compounds
D Cappel et al.
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2005)
Energy partitioning analysis of the bonding in ethylene and acetylene complexes of group 6, 8, and 11 metals:: (CO)5TM-C2Hx and Cl4TM-C2Hx (TM = Cr, Mo, W), (CO)4TM-C2Hx (TM = Fe, Ru, Os), and TM+-C2Hx (TM = Cu, Ag, Au)
MS Nechaev et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2004)
[Pt@Pb12]2-
EN Esenturk et al.
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2004)
The nature of the chemical bond revisited.: An energy partitioning analysis of diatomic molecules E2 (E=N-Bi, F-I), CO and BF
C Esterhuysen et al.
THEORETICAL CHEMISTRY ACCOUNTS (2004)
A stable compound containing a silicon-silicon triple bond
A Sekiguchi et al.
SCIENCE (2004)
Accurate description of van der Waals complexes by density functional theory including empirical corrections
S Grimme
JOURNAL OF COMPUTATIONAL CHEMISTRY (2004)
Decamethyldizincocene, a stable compound of Zn(I) with a Zn-Zn bond
I Resa et al.
SCIENCE (2004)
The significance of π interactions in group 11 complexes with N-heterocyclic carbenes
D Nemcsok et al.
ORGANOMETALLICS (2004)
Activation of H-H, C-H, C-C, and C-Cl bonds by Pd(0). Insight from the activation strain model
A Diefenbach et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2004)
Why is BCl3 a stronger Lewis acid with respect to strong bases than BF3?
F Bessac et al.
INORGANIC CHEMISTRY (2003)
Bis(benzene)chromium is a δ-bonded molecule and ferrocene is a π-bonded molecule
VM Rayón et al.
ORGANOMETALLICS (2003)
Structures and bonding of the sandwich complexes [Ti(η5-E5)2]2- (E = CH, N, P, As, Sb):: A theoretical study
M Lein et al.
INORGANIC CHEMISTRY (2003)
Towards a rigorously defined quantum chemical analysis of the chemical bond in donor-acceptor complexes
G Frenking et al.
COORDINATION CHEMISTRY REVIEWS (2003)
Structures, metal-ligand bond strenght, and bonding analysis of ferrocene derivatives with group-15 heteroligands Fe(η5-E5)2 and FeCp(η5-E5) (E = N, P, As, Sb).: A theoretical study
J Frunzke et al.
ORGANOMETALLICS (2002)
Nature of the metal-ligand bond in M(CO)5PX3 complexes (M = Cr, Mo, W;: X = H, Me, F, Cl):: Synthesis, molecular structure, and quantum-chemical calculations
G Frenking et al.
ORGANOMETALLICS (2002)
Bis(benzene)chromium. 2. Its discovery by E. O. Fischer and W. Hafner and subsequent work by the research groups of E. O. Fischer, H. H. Zeiss, F. Hein, C. Elschenbroich, and others
D Seyferth
ORGANOMETALLICS (2002)
Synthesis and characterization of 2,6-Dipp2-H3C6SnSnC6H3-2,6-Dipp2 (Dipp = C6H3-2,6-Pri2):: A tin analogue of an alkyne
AD Phillips et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2002)
Bis(benzene) chromium. 1. Franz Hein at the University of Leipzig and Harold Zeiss and Minoru Tsutsui at Yale
D Seyferth
ORGANOMETALLICS (2002)
Understanding the nature of the bonding in transition metal complexes: from Dewar's molecular orbital model to an energy partitioning analysis of the metal-ligand bond
G Frenking
JOURNAL OF ORGANOMETALLIC CHEMISTRY (2001)
Oxidative addition of Pd to C-H, C-C and C-Cl bonds: Importance of relativistic effects in DFT calculations
A Diefenbach et al.
JOURNAL OF CHEMICAL PHYSICS (2001)
The nature of the transition metal-carbonyl bond and the question about the valence orbitals of transition metals.: A bond-energy decomposition analysis of TM(CO)6q (TMq = Hf2-_, Ta-, W, Re+, Os2+, Ir3+)
A Diefenbach et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2000)
Synthesis and characterization of 2,6-Trip2H3C6PbPbC6H3-2,6-Trip2 (Trip C6H2-2,4,6-i-Pr3):: A stable heavier group 14 element analogue of an alkyne
LH Pu et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2000)
Share Paper
