B-Hb⋯π interactions in benzene–borazine sandwich and multidecker complexes: a DFT study
Published 2017 View Full Article
- Home
- Publications
- Publication Search
- Publication Details
Title
B-Hb⋯π interactions in benzene–borazine sandwich and multidecker complexes: a DFT study
Authors
Keywords
-
Journal
NEW JOURNAL OF CHEMISTRY
Volume 41, Issue 3, Pages 1293-1302
Publisher
Royal Society of Chemistry (RSC)
Online
2016-12-21
DOI
10.1039/c6nj03545k
References
Ask authors/readers for more resources
Related references
Note: Only part of the references are listed.- B–H···π Interaction: A New Type of Nonclassical Hydrogen Bonding
- (2016) Xiaolei Zhang et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- Reactivity, aromaticity and absorption spectra of pillar[5]arene conformers: A DFT study
- (2015) Pradip Kr. Bhattacharyya Computational and Theoretical Chemistry
- Substituent and Solvent Effects on the Absorption Spectra of Cation−π Complexes of Benzene and Borazine: A Theoretical Study
- (2014) Nabajit Sarmah et al. JOURNAL OF PHYSICAL CHEMISTRY A
- Polarizability, hardness and electrophilicity as global descriptors for intramolecular proton transfer reaction path
- (2014) Sankarlal Ash et al. Computational and Theoretical Chemistry
- Effect of substituent and solvent on cation–π interactions in benzene and borazine: a computational study
- (2013) Kusum K. Bania et al. DALTON TRANSACTIONS
- Origin of Binding of Ammonia–Borane to Transition-Metal-Based Catalysts: An Insight from the Charge and Energy Decomposition Method ETS-NOCV
- (2013) Monika Parafiniuk et al. ORGANOMETALLICS
- Alkylation of guanine by formononetin nitrogen mustard derivatives: A DFT study
- (2013) Sourab Sinha et al. Computational and Theoretical Chemistry
- The accuracy of DFT-optimized geometries of functional transition metal compounds: a validation study of catalysts for olefin metathesis and other reactions in the homogeneous phase
- (2012) Yury Minenkov et al. DALTON TRANSACTIONS
- Quantum Mechanical Design and Structures of Hexanuclear Sandwich Complex and Its Multidecker Sandwich Clusters (Li6)n([18]Annulene)n+1 (n = 1–3)
- (2012) Shu-Jian Wang et al. JOURNAL OF PHYSICAL CHEMISTRY A
- Stability and Reactivity of Methane Clathrate Hydrates: Insights from Density Functional Theory
- (2012) K. R. Ramya et al. JOURNAL OF PHYSICAL CHEMISTRY A
- Theoretical Design of Novel Trinuclear Sandwich Complexes with Central M3Triangles (M = Ni, Pd, Pt)
- (2011) Peng Jin et al. JOURNAL OF PHYSICAL CHEMISTRY A
- Does structural variation in the aziridinium ion facilitate alkylation?
- (2011) Pradip Kr. Bhattacharyya et al. Computational and Theoretical Chemistry
- Effect of Pnictogen Ligand Substitution on a Tripalladium Ditropylium Core
- (2010) Dominic C. Babbini et al. INORGANIC CHEMISTRY
- Spin-orbit effects on electronic delocalization. Aromaticity in a discrete square tetrapalladium sandwich complex
- (2010) A. Muñoz-Castro et al. JOURNAL OF CHEMICAL PHYSICS
- Electronic Delocalization, Energetics, and Optical Properties of Tripalladium Ditropylium Halides, [Pd3(C7H7)2X3]1−(X = Cl−, Br−, and I−)
- (2010) A. Muñoz-Castro et al. JOURNAL OF PHYSICAL CHEMISTRY A
- Substitution Effects of Diborane on the Interaction with Borazine (Inorganic Benzene)
- (2010) P. Ravinder et al. JOURNAL OF PHYSICAL CHEMISTRY A
- Interactions of Boranes and Carboranes with Aromatic Systems: CCSD(T) Complete Basis Set Calculations and DFT-SAPT Analysis of Energy Components†
- (2010) Róbert Sedlák et al. JOURNAL OF PHYSICAL CHEMISTRY A
- Metallocenoids of platinum: Syntheses and structures of triangular triplatinum sandwich complexes of cycloheptatrienyl
- (2010) Tetsuro Murahashi et al. Chemical Science
- Structure, spectroscopy and dynamics of halogen molecules interacting with water
- (2009) Margarita I. Bernal-Uruchurtu§ et al. INTERNATIONAL REVIEWS IN PHYSICAL CHEMISTRY
- On the Structure and Geometry of Biomolecular Binding Motifs (Hydrogen-Bonding, Stacking, X−H···π): WFT and DFT Calculations
- (2009) Kevin E. Riley et al. Journal of Chemical Theory and Computation
- A Systematic CCSD(T) Study of Long-Range and Noncovalent Interactions between Benzene and a Series of First- and Second-Row Hydrides and Rare Gas Atoms
- (2009) Deborah L. Crittenden JOURNAL OF PHYSICAL CHEMISTRY A
- Square Tetrapalladium Sheet Sandwich Complexes: Cyclononatetraenyl as a Versatile Face-Capping Ligand
- (2009) Tetsuro Murahashi et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- Highly Accurate CCSD(T) and DFT-SAPT Stabilization Energies of H-Bonded and Stacked Structures of the Uracil Dimer
- (2008) Michal Pitoňák et al. CHEMPHYSCHEM
- Unique Interactions Between Diborane and π Orbitals: Blue- or Red-Shifted Hydrogen Bonding?
- (2008) Shan Xi Tian et al. JOURNAL OF PHYSICAL CHEMISTRY A
- Reductive Coupling of Metal Triangles in Sandwich Complexes
- (2008) Tetsuro Murahashi et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- Long-range corrected hybrid density functionals with damped atom–atom dispersion corrections
- (2008) Jeng-Da Chai et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
Find the ideal target journal for your manuscript
Explore over 38,000 international journals covering a vast array of academic fields.
SearchAdd your recorded webinar
Do you already have a recorded webinar? Grow your audience and get more views by easily listing your recording on Peeref.
Upload Now