High-resolution infrared absorption spectroscopy of thermally excited naphthalene. Measurements and calculations of anharmonic parameters and vibrational interactions
Literature Information
M. Vervloet, G. Mulas, G. Malloci
We report in this paper the recording and analysis of the vibrational spectrum of naphthalene in the 1.6–200 μm (50–6000 cm−1) spectral range with a resolution of 0.005 cm−1. The spectrum, recorded at room temperature, shows several complex structures in the Q branches of the c-type bands, which can be assigned to hot-band sequences as well as combination bands and overtones. To analyse the experimental data, we developed a model based on anharmonic calculations which predicts the transitions (positions and intensities) involving the vibrational levels populated at room temperature. This work permits us to estimate the validity and limitations of our calculations, which can be used to predict the band profiles of naphthalene (and larger PAHs) at various temperatures, with potential astrophysical applications.
Related Literature
Enhanced flow synthesis of small molecules by in-line integration of sequential catalysis and benchtop twin-column continuous chromatography
Alessandra Sivo, Tae Keun Kim, Vincenzo Ruta, Renzo Luisi, Jose Osorio-Tejada, Marc Escriba-Gelonch, Volker Hessel, Mattia Sponchioni, Gianvito Vilé
DOI: 10.1039/D2RE00242F
Efficient Piancatelli rearrangement on a large scale using the Zippertex technology under subcritical water conditions
Guillaume Arcile, Jamal Ouazzani, Jean-François Betzer
DOI: 10.1039/D2RE00098A
An investigation on PANI/NENP-1 composite as a novel photocatalyst for photocatalytic dye wastewater degradation and photocatalytic hydrogen evolution
Heling Zhang, Huaizhi Yang, Zhiquan Pan, Qingrong Cheng
DOI: 10.1039/D2RE00086E
Production of pentyl valerate from γ-valerolactone, pentanol and H2 using Pd and Rh-based bifunctional catalysts
Karla G. Martínez Figueredo, Emanuel M. Virgilio, Darío J. Segobia, Nicolás M. Bertero
DOI: 10.1039/D2RE00121G
Degradation mechanism of a lignin model compound during alkaline aerobic oxidation: formation of the vanillin precursor from the β-O-4 middle unit of softwood lignin
Yuki Hirano, Akari Izawa, Takashi Hosoya, Hisashi Miyafuji
DOI: 10.1039/D2RE00036A
Process analytical technology (PAT): applications to flow processes for active pharmaceutical ingredient (API) development
Courtney N. Talicska, Eamon C. O'Connell, Howard W. Ward, Angel R. Diaz, Mark A. Hardink, Douglas Connolly, Kevin P. Girard, Tomislav Ljubicic
DOI: 10.1039/D2RE00004K
ZnO nanoflakes self-assembled from the water splitting process using a hydroelectric cell
Jyoti Shah, Abha Shukla, Manoranjan Kar, Govind Gupta, Shipra Jain, R. K. Kotnala
DOI: 10.1039/D2RE00094F
Probing the effects of fructose concentration on the evolution of humins during fructose dehydration
Yexin Hu, Hui Li, Ping Hu, Linzhen Li, Di Wu, Zhidan Xue, Liangfang Zhu, Changwei Hu
DOI: 10.1039/D2RE00324D
Kilo-scale synthesis and purification of 4,4′-[di-t-butyldibenzo]-18-crown-6 and its catalytic reduction to 4,4′-[di-t-butyldicyclohexano]-18-crown-6
Snehasis Dutta, Trilochan Gadly, Amey P. Wadawale, Mayur Darekar, Sulekha Mukhopadhay, Sunil K. Ghosh, Birija S. Patro
DOI: 10.1039/D2RE00047D
You might also like
How should waste containing 2-Ethyl-4-Methyl-1H-Imidazole-5-Carbaldehyde (CAS: 88634-80-4) be handled?
Waste containing 2-Ethyl-4-Methyl-1H-Imidazole-5-Carbaldehyde (CAS: 88634-80-4) ...
What industries use Triethoxy(octyl)silane (CAS: 1385031-14-0)?
Triethoxy(octyl)silane (CAS: 1385031-14-0) is widely used in the pharmaceuticals...
Are there alternatives to 3-iodo-7-nitro-1H-indazole (CAS: 864724-64-1) in synthesis?
Several alternatives to 3-iodo-7-nitro-1H-indazole (CAS: 864724-64-1) exist in t...
Are there alternatives to Benzene, bis[(trimethoxysilyl)ethyl] (CAS: 266317-71-9) in synthesis?
Yes, there are alternatives to Benzene, bis[(trimethoxysilyl)ethyl] (CAS: 266317...
Is Isothiazole-3-carbonitrile (CAS: 1452-17-1) safe?
Isothiazole-3-carbonitrile (CAS: 1452-17-1) is generally considered safe when us...
Is (3-Chlorophenyl)methanol (CAS: 873-63-2) safe?
(3-Chlorophenyl)methanol (CAS: 873-63-2) is considered low to moderately toxic. ...
How is (2S,3S)-2-Hydroxy-3-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-3-(2-naphthyl)propanoic acid (CAS: 959583-98-3) typically synthesized?
(2S,3S)-2-Hydroxy-3-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-3-(2-naphthyl)pr...
What precautions should be taken when handling Methyl 2-(bromomethyl)-5-methoxybenzoate (CAS: 788081-99-2)?
Proper handling of methyl 2-(bromomethyl)-5-methoxybenzoate requires the use of ...
What is 6,8-Dibromoimidazo[1,2-a]pyridine-2-carboxylic acid (CAS: 904805-36-3)?
6,8-Dibromoimidazo[1,2-a]pyridine-2-carboxylic acid (CAS: 904805-36-3) is an aro...
Is 3-Amino-5-bromo-2-pyridinecarbonitrile (CAS: 573675-27-1) safe?
3-Amino-5-bromo-2-pyridinecarbonitrile is considered safe when handled under pro...
Source Journal
Physical Chemistry Chemical Physics

Physical Chemistry Chemical Physics (PCCP) is an international journal co-owned by 19 physical chemistry and physics societies from around the world. This journal publishes original, cutting-edge research in physical chemistry, chemical physics and biophysical chemistry. To be suitable for publication in PCCP, articles must include significant innovation and/or insight into physical chemistry; this is the most important criterion that reviewers and Editors will judge against when evaluating submissions. The journal has a broad scope and welcomes contributions spanning experiment, theory, computation and data science. Topical coverage includes spectroscopy, dynamics, kinetics, statistical mechanics, thermodynamics, electrochemistry, catalysis, surface science, quantum mechanics, quantum computing and machine learning. Interdisciplinary research areas such as polymers and soft matter, materials, nanoscience, energy, surfaces/interfaces, and biophysical chemistry are welcomed if they demonstrate significant innovation and/or insight into physical chemistry. Joined experimental/theoretical studies are particularly appreciated when complementary and based on up-to-date approaches.












![Ethyl 3-((6-(4,5-dihydro-1H-benzo[d]azepin-3(2H)-yl)-2-(pyridin-2-yl)pyrimidin-4-yl)amino)propanoate structure Ethyl 3-((6-(4,5-dihydro-1H-benzo[d]azepin-3(2H)-yl)-2-(pyridin-2-yl)pyrimidin-4-yl)amino)propanoate structure](https://static.chemtradehub.com/structs/137/1373423-53-0-496a.webp)

