![N-[4-(Cyanoethynyl)phenyl]-16-oxo-4,7,10,13-tetraoxa-17-azahenicos-1-yn-21-amide structure](https://static.chemtradehub.com/structs/218/2183440-36-8-68cb.webp "N-[4-(Cyanoethynyl)phenyl]-16-oxo-4,7,10,13-tetraoxa-17-azahenicos-1-yn-21-amide structure")
N-[4-(Cyanoethynyl)phenyl]-16-oxo-4,7,10,13-tetraoxa-17-azahenicos-1-yn-21-amide
CAS Number:
2183440-36-8
Molecular Formula:
C25H31N3O6
Holstein–Peirls–Hubbard trimer as a model for quadrupolar two-photon absorbing dyes
Literature Information
Publication Date
2010-11-16
DOI
10.1039/C0CP00998A
Impact Factor
3.676
Authors
Robertino Pilot, Renato Bozio
View Original
Abstract
The linear and nonlinear optical properties of a Donor–Acceptor–Donor system have been investigated by using a two-electron three-point-site model system. Some basic features of electron correlations are included in the model by means of a bi-electronic density matrix. The polarizabilities and second hyperpolarizabilities have been computed with a modified version of the Collective Electronic Oscillators (CEO) method which allowed us to include the electron–phonon coupling. Both singly- and doubly-excited states are taken into account in the computation of (hyper-)polarizabilities. The effects of electron–phonon coupling on the two-photon absorption and on the third harmonic generation in the infrared region are discussed.
Related Literature
Enzyme-catalyzed synthesis of malonate polyesters and their use as metal chelating materials
Fergal P. Byrne, Jamie M. Z. Assemat, Amy E. Stanford, Thomas J. Farmer
2021-06-29
Communication
DOI: 10.1039/D1GC01783G
Conjugated polymers with controllable interfacial order and energetics enable tunable heterojunctions in organic and colloidal quantum dot photovoltaics
Ahmad R. Kirmani, Xinzheng Lan, Joshua Carpenter, Annabel Rong-Hui Chew, Muhammad R. Niazi, Oleksandr Voznyy, Guy Olivier Ngongang Ndjawa, Alberto Salleo, Harald Ade, Edward H. Sargent
2021-12-24
Paper
DOI: 10.1039/D1TA09544G
Extraordinary role of Hg in enhancing the thermoelectric performance of p-type SnTe
Gangjian Tan, Fengyuan Shi, Jeff W. Doak, Hui Sun, Li-Dong Zhao, Pengli Wang, Ctirad Uher, Chris Wolverton, Vinayak P. Dravid
2014-10-23
Paper
DOI: 10.1039/C4EE01463D
Bio-derived 3D TiO2 hollow spheres with a mesocrystal nanostructure to achieve improved electrochemical performance of Na-ion batteries in ether-based electrolytes
Rongrong Yang, Lanju Sun, Wei Liu, Yuan Zhang, Yongpeng Cui, Yongxiu Du, Shuang Liu, Huanlei Wang, Minghua Huang
2019-01-22
Paper
DOI: 10.1039/C9TA00334G
Facile growth of transition metal hydroxide nanosheets on porous nickel foam for efficient electrooxidation of benzyl alcohol
Xiao-Yuan Wu, Sa-Sa Wang, Weiming Wu
2021-09-06
Paper
DOI: 10.1039/D1GC02218K
Near-critical water, a cleaner solvent for the synthesis of a metal–organic framework
Ilich A. Ibarra, Peter A. Bayliss, Eduardo Pérez, Sihai Yang, Alexander J. Blake, Harriott Nowell, David R. Allan, Martyn Poliakoff, Martin Schröder
2011-11-14
Paper
DOI: 10.1039/C1GC15726D
Potential and limitations of CsBi3I10 as a photovoltaic material
Paz Sebastia-Luna, María C. Gélvez-Rueda, Chris Dreessen, Michele Sessolo, Ferdinand C. Grozema, Francisco Palazon, Henk J. Bolink
2020-05-12
Communication
DOI: 10.1039/D0TA02237C
Nanoparticle counting: towards accurate determination of the molar concentration
Jing Shang, Xiaohu Gao
2014-08-07
Tutorial Review
DOI: 10.1039/C4CS00128A
Construction of mesoporous Cu-doped Co9S8 rectangular nanotube arrays for high energy density all-solid-state asymmetric supercapacitors
Wen Lu, Ze Yuan, Chunyang Xu, Jiqiang Ning, Yijun Zhong, Ziyang Zhang, Yong Hu
2019-02-04
Paper
DOI: 10.1039/C8TA10998B
Freestanding interconnected nanocluster textiles for efficient oxygen evolution reaction
Shougo Higashi, Takashi Tachikawa, Keiichiro Oh-ishi, Keisuke Shigetoh, Kensuke Takechi, Atsushi Beniya
2020-09-24
Paper
DOI: 10.1039/D0TA07707K
You might also like
Compound Q&A
What are the main uses of (5-Sulfamoyl-3-pyridinyl)boronic acid (CAS: 951233-61-7)?
(5-Sulfamoyl-3-pyridinyl)boronic acid is primarily used in chemical synthesis, p...
951233-61-7(5-Sulfamoyl-3-pyrid...
Compound Q&A
How is Benzyl 2-methyl-2-(methylsulfonyl)-4-pentenoate (CAS: 1942858-50-5) typically synthesized?
Benzyl 2-methyl-2-(methylsulfonyl)-4-pentenoate is typically synthesized via est...
1942858-50-5Benzyl 2-methyl-2-(m...
Compound Q&A
What precautions should be taken when handling 8-Fluoroquinolin-6-ol (CAS: 209353-22-0)?
When handling 8-Fluoroquinolin-6-ol (CAS: 209353-22-0), it is important to use p...
209353-22-08-Fluoroquinolin-6-o...
Compound Q&A
What are the physical and chemical properties of 1,3-Dibromo-5-(2-methyl-2-propanyl)benzene (CAS: 129316-09-2)?
1,3-Dibromo-5-(2-methyl-2-propanyl)benzene (CAS: 129316-09-2) is a crystalline c...
129316-09-21,3-Dibromo-5-(2-met...
Compound Q&A
What industries use Ethyl 7-chloro-4-oxo-1-(1,3-thiazol-2-yl)-1,4-dihydro-1,8-naphthyridine-3-carboxylate (CAS: 174726-87-5)?
Ethyl 7-chloro-4-oxo-1-(1,3-thiazol-2-yl)-1,4-dihydro-1,8-naphthyridine-3-carbox...
174726-87-5Ethyl 7-chloro-4-oxo...
Compound Q&A
What precautions should be taken when handling Delta-7-Avenasterol (CAS: 23290-26-8)?
When handling Delta-7-Avenasterol (CAS: 23290-26-8), it is important to wear app...
23290-26-8Delta-7-Avenasterol
Compound Q&A
What precautions should be taken when handling N-({(5R)-3-[3-Fluoro-4-(4-morpholinyl)phenyl]-2-oxo-1,3-oxazolidin-5-yl}methyl)acetamide (CAS: 872992-20-6)?
Proper handling involves the use of personal protective equipment such as gloves...
872992-20-6N-({(5R)-3-[3-Fluoro...
Compound Q&A
What precautions should be taken when handling 2-Methyl-2-proanyl 4-[(2-aminophenyl)amino]-1-piperidinecarboxylate (CAS: 79099-00-6)?
When handling 2-Methyl-2-proanyl 4-[(2-aminophenyl)amino]-1-piperidinecarboxylat...
79099-00-62-Methyl-2-propanyl ...
Compound Q&A
What is N-Methyl-4-chlorobenzylamine hydrochloride (CAS: 65542-24-7)?
N-Methyl-4-chlorobenzylamine hydrochloride (CAS: 65542-24-7) is a organic compou...
65542-24-7N-Methyl-4-chloroben...
Compound Q&A
Is [2-(Dodecyloxy)ethoxy]acetic acid (CAS: 27306-90-7) safe?
[2-(Dodecyloxy)ethoxy]acetic acid (CAS: 27306-90-7) is generally considered safe...
27306-90-7[2-(Dodecyloxy)ethox...
Source Journal
Physical Chemistry Chemical Physics
CiteScore:
5.5
Self-citation Rate:
10.3%
Articles per Year:
3036
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.
Recommended Compounds
amine structure](https://static.chemtradehub.com/structs/629/62924-61-2-0728.webp "[(2-chlorophenyl)methyl](ethyl)amine structure")
Recommended Suppliers
Disclaimer
This page provides academic journal information for reference and research purposes only. We are not affiliated with any journal publishers and do not handle publication submissions. For publication-related inquiries, please contact the respective journal publishers directly.
If you notice any inaccuracies in the information displayed, please contact us at support@chemtradehub.com. We will promptly review and address your concerns.