Tetrel Bonding Interactions in Perchlorinated Cyclopenta- and Cyclohexatetrelanes: A Combined DFT and CSD Study

by Antonio Bauzá, Antonio Frontera
Published 2018-07-01

On the Importance of Halogen–Halogen Interactions in the Solid State of Fullerene Halides: A Combined Theoretical and Crystallographic Study

by Antonio Bauzá, Antonio Frontera
Published 2017-06-01

Chalcogen ‘like-like’ Interactions Involving Trisulphide and Triselenide Compounds: A Combined CSD and Ab Initio Study

by Antonio Bauzá, Antonio Frontera
Published 2018-03-01

Regium-π vs Cation-π Interactions in M2 and MCl (M = Cu, Ag and Au) Complexes with Small Aromatic Systems: An ab Initio Study

by Antonio Bauzá, Antonio Frontera
Published 2018-06-01

RCH3···O Interactions in Biological Systems: Are They Trifurcated H-Bonds or Noncovalent Carbon Bonds?

by Antonio Bauzá, Antonio Frontera
Published 2016-03-01

Substituent Effects in Multivalent Halogen Bonding Complexes: A Combined Theoretical and Crystallographic Study

by Antonio Bauzá, David Quiñonero, Antonio Frontera
Published 2017-12-01

NO3− anions can act as Lewis acid in the solid state

by Antonio Bauzá, Antonio Frontera, Tiddo J. Mooibroek
Published 2017-02-01

Reconciling Experiment and Theory in the Use of Aryl-Extended Calix[4]pyrrole Receptors for the Experimental Quantification of Chloride–π Interactions in Solution

by Antonio Bauzá, David Quiñonero, Antonio Frontera, Pablo Ballester
Published 2015-04-01

Intramolecular Spodium Bonds in Zn(II) Complexes: Insights from Theory and Experiment

by Mainak Karmakar, Antonio Frontera, Shouvik Chattopadhyay, Tiddo J. Mooibroek, Antonio Bauzá
Published 2020-09-01

Coordination Polymers Based on Phthalic Acid and Aminopyrazine Ligands: On the Importance of N–H···π Interactions

by Anowar Hossain, Saikat Kumar Seth, Antonio Bauzá, Subrata Mukhopadhyay, Antonio Frontera
Published 2018-02-01

Structural and Theoretical Evidence of the Depleted Proton Affinity of the N3-Atom in Acyclovir

by Esther Vílchez-Rodríguez, Inmaculada Pérez-Toro, Antonio Bauzá, Antonio Matilla-Hernández
Published 2016-10-01

Novel Pb(II) Complexes: X-Ray Structures, Hirshfeld Surface Analysis and DFT Calculations

by Ghodrat Mahmoudi, Saikat Kumar Seth, Antonio Bauza Riera, Fedor Ivanovich Zubkov, Antonio Frontera
Published 2020-07-01

Synthesis, X-ray Characterization and Density Functional Theory (DFT) Studies of Two Polymorphs of the α,α,α,α, Isomer of Tetra-<i>p</i>-Iodophenyl Tetramethyl Calix[4]pyrrole: On...

by Dragoș Dăbuleanu, Antonio Bauzá, Joaquín Ortega-Castro, Eduardo C. Escudero-Adán, Pablo Ballester, Antonio Frontera
Published 2020-01-01

Short X···N Halogen Bonds With Hexamethylenetetraamine as the Acceptor

by Goulielmina Anyfanti, Goulielmina Anyfanti, Antonio Bauzá, Lorenzo Gentiluomo, Lorenzo Gentiluomo, João Rodrigues, Gustavo Portalone, Antonio Frontera, Kari Rissanen, Rakesh Puttreddy
Published 2021-04-01

Cu(II)–N6-Alkyladenine Complexes: Synthesis, X-ray Characterization and Magnetic Properties

by María Soledad Martínez, Antonio Bauzá, Amparo Caubet, Ángel García-Raso, Ángel Terrón, Juan J. Fiol, Elies Molins, Miquel Barceló-Oliver, Antonio Frontera
Published 2018-05-01

Bioactive Heterometallic CuII–ZnII Complexes with Potential Biomedical Applications

by Ishani Majumder, Prateeti Chakraborty, Raquel Álvarez, Myriam Gonzalez-Diaz, Rafael Peláez, Younes Ellahioui, Antonio Bauza, Antonio Frontera, Ennio Zangrando, Santiago Gómez-Ruiz, Debasis Das
Published 2018-10-01