Molekularstruktur und Fluoreszenz aus ππ*-angeregten Zuständen organischer Moleküle/ Molecular Structure and Fluorescence from ππ* Excited States of Organic Molecules

1975 ◽  
Vol 30 (12) ◽  
pp. 1691-1695
Author(s):  
Filip Fratev
Keyword(s):  
Molecular Structure ◽  
Excited States ◽  
Organic Molecules ◽  
Preceding Paper ◽  
Molecular Structures ◽  
Dual Fluorescence ◽  
Large Classes ◽  
Conjugated Organic Molecules

Abstract Molecular The classification of the types of excited molecular structures suggested in a preceding paper1, can be used for interpretation and prediction of fluorescence ability of large classes of conjugated organic molecules. Possible electronic conditions for S2- and dual fluorescence are discussed. An extension of Kasha's rule is suggested.

scholarly journals Exploiting trifluoromethyl substituents for tuning orbital character of singlet and triplet states to increase the rate of thermally activated delayed fluorescence

2020 ◽  
Vol 4 (12) ◽  
pp. 3602-3615 ◽  
Author(s):  
Jonathan S. Ward ◽  
Andrew Danos ◽  
Patrycja Stachelek ◽  
Mark A. Fox ◽  
Andrei S. Batsanov ◽  
...  
Keyword(s):  
Excited States ◽  
Organic Molecules ◽  
Delayed Fluorescence ◽  
Triplet States ◽  
Thermally Activated Delayed Fluorescence ◽  
Thermally Activated ◽  
Conjugated Organic Molecules ◽  
Singlet And Triplet States ◽  
Triplet Excited States ◽  
Orbital Character

This work shows that trifluoromethyl (CF3) substituents can be used to increase the rate of thermally activated delayed fluorescence (TADF) in conjugated organic molecules by tuning the excitonic character of the singlet and triplet excited states.

Quantification and classification of substituent effects in organic chemistry: a theoretical molecular electrostatic potential study

2016 ◽  
Vol 18 (30) ◽  
pp. 20615-20626 ◽  
Author(s):  
Geetha S. Remya ◽  
Cherumuttathu H. Suresh
Keyword(s):  
Organic Chemistry ◽  
Electrostatic Potential ◽  
Molecular Electrostatic Potential ◽  
Organic Molecules ◽  
Substituent Effects ◽  
Conjugated Organic Molecules ◽  
Hammett Constants ◽  
Strong Linear Correlation ◽  
Potential Parameters

The molecular electrostatic potential parameters show a strong linear correlation with Hammett constants and serve as tools for designing π-conjugated organic molecules with highly tuned electronic properties.

scholarly journals An investigation of the interrelationships between linear and nonlinear polarizabilities and bond-length alternation in conjugated organic molecules

1993 ◽  
Vol 90 (23) ◽  
pp. 11297-11301 ◽  
Author(s):  
C B Gorman ◽  
S R Marder
Keyword(s):  
Bond Length ◽  
Organic Molecules ◽  
Computational Method ◽  
Bond Length Alternation ◽  
Conjugated Molecules ◽  
Conjugated Organic Molecules ◽  
Alpha Beta ◽  
Relationship Of ◽  
The Relationship ◽  
Observable Parameter

A computational method was devised to explore the relationship of charge separation, geometry, molecular dipole moment (mu), polarizability (alpha), and hyperpolariz-abilities (beta, gamma) in conjugated organic molecules. We show that bond-length alternation (the average difference in length between single and double bonds in the molecule) is a key structurally observable parameter that can be correlated with hyperpolarizabilities and is thus relevant to the optimization of molecules and materials. By using this method, the relationship of bond-length alternation, mu, alpha, beta, and gamma for linear conjugated molecules is illustrated, and those molecules with maximized alpha, beta, and gamma are described.

Metaphoric chains

2021 ◽  
Vol 19 (2) ◽  
pp. 273-298
Author(s):  
Sakineh Navidi-Baghi ◽  
Ali Izanloo ◽  
Alireza Qaeminia ◽  
Alireza Azad
Keyword(s):  
Molecular Structure ◽  
Conceptual Metaphor ◽  
Previous Literature ◽  
Molecular Structures ◽  
Conceptual Metaphor Theory ◽  
Metaphor Theory ◽  
Different Types ◽  
New Form

Abstract The molecular structure of a complex metaphor comprises two or more atomic metaphorical parts, known as primary metaphors. In the same way, several molecular structures of metaphors may combine and form a mixture, known as mixed metaphors. In this study, different types of metaphoric integrations are reviewed and illustrated in figures to facilitate understanding the phenomena. Above all, we introduce double-ground metaphoric chain, a new form of metaphoric integration that has not been identified in the previous literature. Also, a distinction is made between single-ground and double-ground metaphoric chains. In the former, which has already been introduced, two basic metaphors are chained with the same form and have the same ground, while the latter includes two chained metaphors, one main metaphor plus a supportive one, with different grounds. In this analysis, we benefited from Conceptual Metaphor Theory (CMT) to analyse double-ground metaphoric chains. This study suggests that each metaphoric integration leads to a multifaceted conceptualization, in which each facet is related to one of the constituent micro-metaphors.

Influence of conjugation length on ultrafast electronic tunneling in organic semiconductor thin films

2018 ◽  
Vol 20 (38) ◽  
pp. 25085-25095 ◽  
Author(s):  
Vincent V. Duong ◽  
Alexander L. Ayzner
Keyword(s):  
Molecular Electronics ◽  
Organic Molecules ◽  
Electron Delocalization ◽  
Conjugation Length ◽  
Conjugated Organic Molecules ◽  
Rate Limiting Step ◽  
Limiting Step ◽  
Semiconductor Thin Films ◽  
Electronic Tunneling ◽  
Rate Limiting

Electron delocalization in conjugated organic molecules is a rate-limiting step in maximizing the photo conversion efficiency of next generation photovoltaics and molecular electronics.

Chemical sensors based on π-conjugated organic molecules and gold nanoparticles

2009 ◽  
Vol 52 (6) ◽  
pp. 715-730 ◽  
Author(s):  
MingJian Yuan ◽  
YongJun Li ◽  
HuiBiao Liu ◽  
YuLiang Li
Keyword(s):  
Gold Nanoparticles ◽  
Chemical Sensors ◽  
Organic Molecules ◽  
Conjugated Organic Molecules

scholarly journals Insights into the Intrinsic Factors Affecting the NIR Reflectance Based on Rylene Diimide Molecules

Materials ◽  
2021 ◽  
Vol 14 (18) ◽  
pp. 5269
Author(s):  
Weili Zeng ◽  
Yujie Song ◽  
Jianning Zhang ◽  
Hong Chen ◽  
Ming Liu ◽  
...  
Keyword(s):  
Molecular Structure ◽  
Molecular Structures ◽  
Heat Radiation ◽  
Clear Understanding ◽  
Factors Affecting ◽  
Intrinsic Factors ◽  
Alkyl Groups ◽  
Amine Groups

A clear understanding of the relationships between molecular structure and NIR reflectance (700–2500 nm) behavior is important and highly desirable for developing appropriate NIR-reflective materials to combat NIR heat radiation from sunlight. In this research, three groups of imide-based compounds have been adopted to investigate the influence of the intrinsic molecular structures on the NIR-reflective properties. It is found out that for the compounds with alkyl groups, the NIR reflectance will increase as the degree of the conjugated backbone increases, especially for the reflectance from 1750 nm to 2500 nm. In addition, despite that the alkyl or amine groups deteriorate the NIR reflectance, the NIR reflectance varies within a certain interval and the isomers with branched alkyl groups show identical or smaller NIR reflectance than those of isomers with linear alkyl groups. For different compounds, crystallinity seems to almost have no relationship with their NIR reflectance.

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