ArticleMolecules (Basel, Switzerland)2020
The Role of State-of-the-Art Quantum-Chemical Calculations in Astrochemistry: Formation Route and Spectroscopy of Ethanimine as a Paradigmatic Case.
Article in Molecules (Basel, Switzerland), 2020. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 12 papers.
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Who cites it
12 citing papers in PubMed.
- URVAvis: A Graphical User Interface for the Visual Mechanistic Analysis of Chemical Reactions Based on the Unified Reaction Valley Approach.The journal of physical chemistry. A · 2026Article
- Interstellar Stereoisomerism.ACS earth & space chemistry · 2026Review
- Elastic Electron Collisions with Cyanoacetylene.ACS physical chemistry Au · 2025Article
- The Radiative Efficiency and Global Warming Potential of HCFC-132b.Chemphyschem : a European journal of chemical physics and physical chemistry · 2025Article
- Formation of acetonitrile (CHScientific reports · 2024Article
- Energetics of the OH radical H-abstraction reactions from simple aldehydes and their geminal diol forms.Journal of molecular modeling · 2024Article
- Toward an Accurate Black-Box Tool for the Kinetics of Gas-Phase Reactions Involving Barrier-less Elementary Steps.Journal of chemical theory and computation · 2023Article
- Reliable Gas Phase Reaction Rates at Affordable Cost by Means of the Parameter-Free JunChS-F12 Model Chemistry.Journal of chemical theory and computation · 2023Article
- Development and Validation of a Parameter-Free Model Chemistry for the Computation of Reliable Reaction Rates.Journal of chemical theory and computation · 2021Article
- Isomerization and Fragmentation Reactions on the [CThe Journal of organic chemistry · 2021Article
- Photodestruction of Diatomic Molecular Ions: Laboratory and Astrophysical Application.Molecules (Basel, Switzerland) · 2020Article
- Accuracy Meets Interpretability for Computational Spectroscopy by Means of Hybrid and Double-Hybrid Functionals.Frontiers in chemistry · 2020Article
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Authors and funding
5 authors.
Funding
Abstract
The gas-phase formation and spectroscopic characteristics of ethanimine have been re-investigated as a paradigmatic case illustrating the accuracy of state-of-the-art quantum-chemical (QC) methodologies in the field of astrochemistry. According to our computations, the reaction between the amidogen, NH, and ethyl, C
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Registered trials
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