Theoretical chemist @cinvestav Merida. Associate Editor for @ChemicalScience. Member of the IAB of @angew_chem. Fellow of @RoySocChem. Co-Founder of @LatinXChem
A year ago, amid the pandemic, we proposed that @RoySocChem should compile a collection of Latin American contributions to chemistry. The collection was well received; 24 journals and 16 editors participated in the selection/1
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https://t.co/OhYp0m03bq
Our latest work in PCCP @PCCP@RoySocChem, Xenon can form energetically stable and potentially covalent bonds. “Covalent bonding and extreme shielding in xenon–icosagen fluoride cations”
@Abril_C_Castro@theochemmerida@OscarHalla
https://t.co/q4aoSoEg0H
New Paper: Planar and Pyramidal Pentacoordinate Selenium Atoms in Chemistry – A European Journal @ChemEurJ
With @luzdiego11 and @theochemmerida
Congratulations Luz ‼️
https://t.co/1kIcci7zEk
I’m very pleased to share our new paper in @angew_chem. We integrate substituent effects into the classical Wade–Mingos rules for dicarboranes.
Analysis of 74,613 C2B4R6 clusters reveals that substituents (not only electron pairs) govern stability.
https://t.co/uK8dlF6126
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I’m very pleased to share our new paper in @angew_chem. We integrate substituent effects into the classical Wade–Mingos rules for dicarboranes.
Analysis of 74,613 C2B4R6 clusters reveals that substituents (not only electron pairs) govern stability.
https://t.co/uK8dlF6126
🇲🇽🇨🇳🇺🇸
Our latest study explores the PES of the dianion B10H14(2-), revealing a more stable B10H10(2-)⋯2H2 complex, 21.5 kcal/mol lower in energy than the known arachno structure.
Kudos to @gerardo0339@murillofmc@FOrtizChi@jbarrozom and Alejandro Vásquez
https://t.co/albt65Vo3V
Zeise's salt, the first organometallic compound synthesized (1825), is σ-aromatic.
This study is the result of a fruitful collaboration with Ankur @AnkurKGuha, Marieta @mafernan9, and Mesias @MesiasOrozco, and has just been published in @InorgChem
https://t.co/FAptCpjcnT
Excited to share our new publication in Organic Chemistry Frontiers!
Together with @capvalr, Miguel Angel Vazquez, @APoater, and @OscarHalla, we explored the reactivity of 1,2,5-azadiborolidine derivatives toward CO.
📖 Read the full article here: https://t.co/IsN1iTxjT9
Exciting news! Eyringpy 3.0 is now available. This release adds Variational Transition State Theory (VTST) and the Hindered Rotor Model for kinetic rate constants.
@VioletaDzib@alanqf22@FOrtizChi
https://t.co/9Y5HILiNVV
Sobre el peso de publicar en las revistas científicas -y el estigma de publicar fuera de ellas-, lean este artículo de Gabriel Merino @theochemmerida, en el que explica por qué es clave que la ciencia sea comunicable para todos los públicos https://t.co/o7PdCgUHGG
Mi colega y amigo @theochemmerida escribió esta interesante columna de opinión sobre "El estigma de publicar (para un científico)" en @eleconomista
Vale la pena darle una buena leída.
https://t.co/6zWrojCOfU
And when we thought we already knew all possible small molecules, N6 suddenly appears🤯
One of the most beautiful papers of the 21st century was published yesterday.
https://t.co/gdMwvm1OW9
Our new @JPhysChem paper explores C₂H₇NO isomers, identifying 8 structures incl. 1-aminoethanol (global min) & methylaminomethanol. Rotational constants and conformer data support ISM searches for N/O organics.
@1LissNoor@FOrtizChi@LuisOrt42601377
https://t.co/2YgbwGmv8S
New paper in @PCCP! We explore the structure, bonding & reactivity of C₃H₂Au⁺, C₃HAu₂⁺ & C₃Au₃⁺. Cyclic isomers support the Au–H analogy & show aromatic 3c–2e π-bonding. C–Au covalency shapes reactivity.
@rafael_islas@cerpa_erick@luzdiego11
https://t.co/FvqpVTDWVx
Our latest work in PCCP @PCCP@RoySocChem Tuning of aromaticity and reactivity in gold-substituted cyclopropenyl cations “These results offer valuable insights for designing novel gold–carbon clusters.”
@theochemmerida@rafael_islas@ndariaso@luzdiego11
https://t.co/JeNwC7w8Zc