Cargando…

Computational studies on the gas phase reaction of methylenimine (CH(2)NH) with water molecules

In this work, we used quantum chemical methods and chemical kinetic models to answer the question of whether or not formaldehyde (CH(2)O) and ammonia (NH(3)) can be produced from gas phase hydration of methylenimine (CH(2)NH). The potential energy surfaces (PESs) of CH(2)NH + H(2)O → CH(2)O + NH(3)...

Descripción completa

Detalles Bibliográficos
Autor principal:	Ali, Mohamad Akbar
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	Nature Publishing Group UK 2020
Materias:	Article
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7335075/ https://www.ncbi.nlm.nih.gov/pubmed/32620911 http://dx.doi.org/10.1038/s41598-020-67515-3

Ejemplares similares

Can a single ammonia and water molecule enhance the formation of methanimine under tropospheric conditions?: kinetics of (•)CH(2)NH(2) + O(2) (+NH(3)/H(2)O)
por: Dash, Manas Ranjan, et al.
Publicado: (2023)

Effect of ammonia and water molecule on OH + CH(3)OH reaction under tropospheric condition
por: Ali, Mohamad Akbar, et al.
Publicado: (2021)

Hydroxyl transfer versus cyclization reaction in the gas phase: Sequential loss of NH(3) and CH(2)CO from protonated phenylalanine derivatives
por: Zheng, Mingyu, et al.
Publicado: (2023)

About the Formation of NH(2)OH(+) from Gas Phase Reactions under Astrochemical Conditions
por: Dilena, Gabriele, et al.
Publicado: (2023)

Hybrid Chlorides with Methylhydrazinium Cation: [CH(3)NH(2)NH(2)]CdCl(3) and Jahn-Teller Distorted [CH(3)NH(2)NH(2)]CuCl(3)
por: Zienkiewicz, Jan A., et al.
Publicado: (2023)

On the Electron-Induced Reactions of (CH(3))AuP(CH(3))(3): A Combined UHV Surface Science and Gas-Phase Study
por: Kamali, Ali, et al.
Publicado: (2022)

Solid-Phase Synthesis of Gly-Ψ[CH(CF(3))NH]-Peptides
por: Sgorbati, Clara, et al.
Publicado: (2021)

On the Gas-Phase Interactions of Alkyl and Phenyl Formates with Water: Ion–Molecule Reactions with Proton-Bound Water Clusters
por: Diedhiou, Malick, et al.
Publicado: (2023)

A Variety of Phase‐Transition Behaviors in a Niccolite Series of [NH(3)(CH(2))(4)NH(3)][M(HCOO)(3)](2)
por: Shang, Ran, et al.
Publicado: (2016)

Density functional theory study of Mobius boron-carbon-nitride as potential CH(4), H(2)S, NH(3), COCl(2) and CH(3)OH gas sensor
por: Ahmed, Mohammad Tanvir, et al.
Publicado: (2022)

Computational Studies of Coinage Metal Anion M(−) + CH(3)X (X = F, Cl, Br, I) Reactions in Gas Phase
por: Wang, Fan, et al.
Publicado: (2022)

The Role of (H(2)O)(1-2) in the CH(2)O + ClO Gas-Phase Reaction
por: Li, Junyao, et al.
Publicado: (2018)

Study on structural geometry and dynamic property of [NH(3)(CH(2))(5)NH(3)]CdCl(4) crystal at phases I, II, and III
por: Lim, Ae Ran, et al.
Publicado: (2022)

Effect of (H(2)O)(n) (n = 0–3, 13) on the NH(3) + OH reaction in the gas and liquid phases
por: Zhou, Yujie, et al.
Publicado: (2022)

Novel hypophosphite hybrid perovskites of [CH(3)NH(2)NH(2)][Mn(H(2)POO)(3)] and [CH(3)NH(2)NH(2)][Mn(H(2)POO)(2.83)(HCOO)(0.17)] exhibiting antiferromagnetic order and red photoluminescence
por: Mączka, Mirosław, et al.
Publicado: (2020)

Structural dynamics of CH(3)NH(3)(+) and PbBr(3)(−) in tetragonal and cubic phases of CH(3)NH(3)PbBr(3) hybrid perovskite by nuclear magnetic resonance
por: Lim, Ae Ran, et al.
Publicado: (2020)

Unexpected steric hindrance failure in the gas phase F(−) + (CH(3))(3)CI S(N)2 reaction
por: Lu, Xiaoxiao, et al.
Publicado: (2022)

Ab Initio and Statistical Rate Theory Exploration of the CH (X(2)Π) + OCS Gas-Phase Reaction
por: Lucas, Daniel I., et al.
Publicado: (2023)

Gas-phase reaction mechanism in chemical dry etching using NF(3) and remotely discharged NH(3)/N(2) mixture
por: Matsugi, Akira, et al.
Publicado: (2020)

Phase transition, thermal stability, and molecular dynamics of organic–inorganic hybrid perovskite [NH(3)(CH(2))(6)NH(3)]CuCl(4) crystals
por: Choi, Moon Young, et al.
Publicado: (2022)

Roaming‐Mediated CH(2)NH Elimination from the Ionization of Aromatic Ethylamines
por: Zhang, Mengxing, et al.
Publicado: (2017)

Thermal, ferroelastic, and structural properties near phase transitions of organic–inorganic perovskite type [NH(3)(CH(2))(3)NH(3)]CdBr(4) crystals
por: Lim, Ae Ran
Publicado: (2021)

Organic–inorganic hybrid [NH(3)(CH(2))(6)NH(3)]ZnBr(4) crystal: structural characterization, phase transitions, thermal properties, and structural dynamics
por: Lim, Ae Ran, et al.
Publicado: (2022)

Growth, structure, phase transition, thermal properties, and structural dynamics of organic–inorganic hybrid [NH(3)(CH(2))(5)NH(3)]ZnCl(4) crystal
por: Lim, Ae Ran, et al.
Publicado: (2022)

Pressure-induced transformation of CH(3)NH(3)PbI(3): the role of the noble-gas pressure transmitting media
por: Arakcheeva, Alla, et al.
Publicado: (2019)

Infrared and 2-Dimensional Correlation Spectroscopy Study of the Effect of CH(3)NH(3)PbI(3) and CH(3)NH(3)SnI(3) Photovoltaic Perovskites on Eukaryotic Cells
por: Quaroni, Luca, et al.
Publicado: (2020)

Phase Stability and Electronic Properties of Hybrid Organic–Inorganic Perovskite Solid Solution (CH(NH(2))(2))(x)(CH(3)NH(3))(1–x)Pb(Br(y)I(1–y))(3) as a Function of Composition
por: Chan, T. H., et al.
Publicado: (2022)

Relativistic GW calculations on CH(3)NH(3)PbI(3) and CH(3)NH(3)SnI(3) Perovskites for Solar Cell Applications
por: Umari, Paolo, et al.
Publicado: (2014)

Plasma-Triggered CH(4)/NH(3) Coupling Reaction for Direct Synthesis of Liquid Nitrogen-Containing Organic Chemicals
por: Yi, Yanhui, et al.
Publicado: (2017)

Strong Linear Correlation between CH(3)NH(2) Molecular Defect and THz-Wave Absorption in CH(3)NH(3)PbI(3) Hybrid Perovskite Thin Film
por: Maeng, Inhee, et al.
Publicado: (2020)

Preparation of methanediamine (CH(2)(NH(2))(2))—A precursor to nucleobases in the interstellar medium
por: Marks, Joshua H., et al.
Publicado: (2022)

Studies on the Kinetics of the CH + H(2) Reaction and Implications for the Reverse Reaction, (3)CH(2) + H
por: Blitz, Mark A., et al.
Publicado: (2023)

Gas Phase Reaction of Silane with Water at Different Temperatures and Supported by Plasma
por: Szafarska, Maik, et al.
Publicado: (2023)

Numerical Simulation of NH(3)(CH(2))(2)NH(3)MnCl(4) Based Pb-Free Perovskite Solar Cells Via SCAPS-1D
por: Ahmad, Khursheed, et al.
Publicado: (2022)

Physicochemical Property Investigations of Perovskite-Type Layer Crystals [NH(3)(CH(2))(n)NH(3)]CdCl(4) (n = 2, 3, and 4) as a Function of Length n of CH(2)
por: Lim, Ae Ran, et al.
Publicado: (2021)

Experimental identification of aminomethanol (NH(2)CH(2)OH)—the key intermediate in the Strecker Synthesis
por: Singh, Santosh K., et al.
Publicado: (2022)

Adsorption Behavior of CH(4) Gas Molecule on the MoX(2)(S, Se, Te) Monolayer: The DFT Study
por: Ren, Jian, et al.
Publicado: (2019)

Advances in physicochemical characterization of lead-free hybrid perovskite [NH(3)(CH(2))(3)NH(3)]CuBr(4) crystals
por: Lim, Ae Ran, et al.
Publicado: (2022)

Spontaneous bidirectional ordering of CH(3)NH(3)(+) in lead iodide perovskites at room temperature: The origins of the tetragonal phase
por: Deretzis, Ioannis, et al.
Publicado: (2016)

Observation of the simplest Criegee intermediate CH(2)OO in the gas-phase ozonolysis of ethylene
por: Womack, Caroline C., et al.
Publicado: (2015)

Cannot write session to /tmp/vufind_sessions/sess_mo52g3a8rksgbd0ibugr75i89p