Results 101 to 110 of about 62,639 (186)

Electronic Structure and Electron Delocalization in Bare and Dressed Boron Pentamer Clusters. [PDF]

J Phys Chem A, 2021
Mercero JM, Ugalde JM.
europepmc   +1 more source

Visualizing electron delocalization in contorted polycyclic aromatic hydrocarbons. [PDF]

Chem Sci, 2021
Artigas A, Hagebaum-Reignier D, Carissan Y, Coquerel Y.   +3 more
europepmc   +1 more source

Tracking the Transition from Pericyclic to Pseudopericyclic Reaction Mechanisms Using Multicenter Electron Delocalization Analysis: The [1,3] Sigmatropic Rearrangement. [PDF]

J Phys Chem A, 2021
Pérez-Barcia Á, Peña-Gallego Á, Mandado M.   +2 more
europepmc   +1 more source

Steric effects vs. electron delocalization: a new look into the stability of diastereomers, conformers and constitutional isomers. [PDF]

RSC Adv, 2021
Datta S, Limpanuparb T.
europepmc   +1 more source

Rigid-flexible heptazine-biguanide frameworks enable fast electron delocalization and low-steric-hindrance ammonium-ion storage. [PDF]

Sci Adv
Du W, Zhang Y, Duan H, Lv Y, Song Z, Gan L, Liu M.   +6 more
europepmc   +1 more source

Quantifying the Effect of Intermonomer Improper Angles on Electron Delocalization in Conjugated Polymers. [PDF]

J Phys Chem B
Ramji RS, Kleinschmidt AT, Bhamidipati S, Zhang L, Chen AX, Pascal TA, Lipomi DJ.   +6 more
europepmc   +1 more source

Interpreting Ring Currents from Hückel-Guided σ- and π-Electron Delocalization in Small Boron Rings. [PDF]

Molecules
Sacanamboy DS, García-Argote W, Pumachagua-Huertas R, Cárdenas C, Leyva-Parra L, Ruiz L, Tiznado W.   +6 more
europepmc   +1 more source

Reassessing the Possibility of π-σ-π Full Electron Delocalization Through 3D Aromatic Carboranes. [PDF]

Chemistry
Gao Y, Szathmári B, Buzsáki D, Kelemen Z.   +3 more
europepmc   +1 more source

The Aromaticity of Osmapentalenes Derivatives - An Analysis Based on Electron-Delocalization Indices. [PDF]

Chemphyschem
Grande-Aztazi R, Matito E, Ugalde JM, Mercero JM.   +3 more
europepmc   +1 more source

Characterization of Cyclic [n]Spirobifluorenylene Compounds and Electron Delocalization in Their Radical Cation Species. [PDF]

Chem Asian J
Imai T, Amaya T.
europepmc   +1 more source