Dipole moments in excited state. Statistical investigation of methods employing solvatochromism

Bohumír Koutek

doi:10.1135/cccc19782368

Dipole moments in excited state. Statistical investigation of methods employing solvatochromism

Collection of Czechoslovak Chemical Communications ◽

10.1135/cccc19782368 ◽

1978 ◽

Vol 43 (9) ◽

pp. 2368-2386 ◽

Cited By ~ 63

Author(s):

Bohumír Koutek

Keyword(s):

Excited State ◽

Dipole Moments ◽

Statistical Investigation

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Erratum: Excited‐state dipole moments, polarizabilities, and local fields in molecular crystals; polarizabilities of benzophenone in its lowest singlet and triplet n π* excited states

The Journal of Chemical Physics ◽

10.1063/1.1679129 ◽

1973 ◽

Vol 58 (11) ◽

pp. 5192-5192 ◽

Cited By ~ 2

Author(s):

J. W. Barker ◽

L. J. Noe

Keyword(s):

Excited State ◽

Excited States ◽

Dipole Moments ◽

Molecular Crystals ◽

Local Fields ◽

Excited State Dipole Moments

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Study of the novel fluorescent 4-methyl-9-(3-oxobutanoyl)-2H,8H-pyrano[2,3-f]chromene-2,8-dione derivative. Estimation of the ground- and excited-state dipole moments from a solvatochromic shift

Journal of Molecular Structure ◽

10.1016/j.molstruc.2017.05.110 ◽

2017 ◽

Vol 1146 ◽

pp. 285-291 ◽

Cited By ~ 6

Author(s):

Ahmed Al-Kawkabani ◽

Malika Makhloufi-Chebli ◽

Nadjib Benosmane ◽

Baya Boutemeur-Kheddis ◽

Maamar Hamdi ◽

...

Keyword(s):

Excited State ◽

Dipole Moments ◽

The Novel ◽

Solvatochromic Shift ◽

Derivative Estimation ◽

Dione Derivative ◽

Excited State Dipole Moments

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Solvatochromic Study of Supramolecular Amphiphile Based on Calix[4]arene Connected to a Fluorescent Benzofurazan Moiety at Lower Rim: Evaluation of Ground and Excited State Dipole Moments

Optics and Spectroscopy ◽

10.1134/s0030400x20120929 ◽

2020 ◽

Vol 128 (12) ◽

pp. 1993-1999

Author(s):

S. Joshi

Keyword(s):

Excited State ◽

Dipole Moments ◽

Excited State Dipole Moments

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Estimation of ground state and excited state dipole moments of a novel Schiff base derivative containing 1, 2, 4-triazole nucleus by solvatochromic method

Journal of Molecular Liquids ◽

10.1016/j.molliq.2015.12.050 ◽

2016 ◽

Vol 215 ◽

pp. 387-395 ◽

Cited By ~ 20

Author(s):

Roshmy Alphonse ◽

Anitha Varghese ◽

Louis George ◽

Aatika Nizam

Keyword(s):

Schiff Base ◽

Excited State ◽

Ground State ◽

Dipole Moments ◽

Solvatochromic Method ◽

Base Derivative ◽

Excited State Dipole Moments

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Emerging ground and excited state dipole moments and external electric field effect on electronic structure. A solvatochromism and theoretical study on 2-((phenylimino)methyl)phenol derivatives

Journal of Molecular Liquids ◽

10.1016/j.molliq.2015.01.056 ◽

2015 ◽

Vol 206 ◽

pp. 56-67 ◽

Cited By ~ 15

Author(s):

İsa Sıdır ◽

Yadigar Gülseven Sıdır ◽

Halil Berber ◽

Ferhat Demiray

Keyword(s):

Electronic Structure ◽

Excited State ◽

Electric Field ◽

Field Effect ◽

Theoretical Study ◽

Dipole Moments ◽

Electric Field Effect ◽

Phenol Derivatives ◽

Excited State Dipole Moments ◽

External Electric Field Effect

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Ground state and excited state dipole moments of alkyl substituted para-nitroaniline derivatives

Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy ◽

10.1016/j.saa.2008.04.008 ◽

2008 ◽

Vol 71 (4) ◽

pp. 1355-1359 ◽

Cited By ~ 3

Author(s):

R. Dhanya ◽

V.C. Kishore ◽

C. Sudha Kartha ◽

K. Sreekumar ◽

Rani Joseph

Keyword(s):

Excited State ◽

Ground State ◽

Dipole Moments ◽

Excited State Dipole Moments

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Excited state dipole moments of nitrobenzene derivatives

Journal of the Chemical Society Perkin Transactions 2 ◽

10.1039/p29780000849 ◽

1978 ◽

pp. 849 ◽

Cited By ~ 9

Author(s):

Salvatore Millefiori ◽

Felice Zuccarello ◽

Giuseppe Buemi

Keyword(s):

Excited State ◽

Dipole Moments ◽

Excited State Dipole Moments

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Photophysical study of 6-amino-3-methyl-4-(4-nitrophenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile and estimation of ground-state and singlet excited-state dipole moments by solvatochromic approaches

Journal of Molecular Liquids ◽

10.1016/j.molliq.2016.07.133 ◽

2016 ◽

Vol 222 ◽

pp. 828-835 ◽

Cited By ~ 6

Author(s):

Rekha Kumari ◽

Anitha Varghese ◽

Louis George ◽

Akshaya K.B.

Keyword(s):

Excited State ◽

Ground State ◽

Dipole Moments ◽

Singlet Excited State ◽

Photophysical Study ◽

Excited State Dipole Moments

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Excited State Dipole Moments in Solution: Comparison between State-Specific and Linear-Response TD-DFT Values

Journal of Chemical Theory and Computation ◽

10.1021/acs.jctc.7b01230 ◽

2018 ◽

Vol 14 (3) ◽

pp. 1544-1553 ◽

Cited By ~ 21

Author(s):

Ciro Achille Guido ◽

Benedetta Mennucci ◽

Giovanni Scalmani ◽

Denis Jacquemin

Keyword(s):

Excited State ◽

Linear Response ◽

Dipole Moments ◽

Td Dft ◽

Excited State Dipole Moments

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Studies on Photophysical Properties of Mono-carbonyl Curcumin Analogues: Experimental and Theoretical approach

Oriental Journal Of Chemistry ◽

10.13005/ojc/3404059 ◽

2018 ◽

Vol 34 (4) ◽

pp. 2170-2179

Author(s):

Manjula Rayanal ◽

Prasad Pralhad Pujar ◽

Sridhar D

Keyword(s):

Excited State ◽

Ground State ◽

Dipole Moments ◽

Photophysical Properties ◽

Stokes Shift ◽

Solvent Polarity ◽

Frontier Molecular Orbital ◽

Curcumin Analogues ◽

Td Dft ◽

Ground State Dipole Moments

The solvatochromic fluorescence behaviour of mono-carbonyl curcumin analogues has been studied in ten different solvents ranging from non-polar to polar. The solvent effect on the spectral properties of analogues has been discussed. The ground state dipole moments were estimated experimentally by Bilot-Kawski equation which is a function of Stokes shift with the solvent polarity parameters and Guggenheim method and theoretically by TD-DFT studies. The excited state dipole moment was determined using Bilot-Kawski equations. The excited state dipole moments for the two molecules were found to be higher than their corresponding ground state dipole moments. Theoretically Frontier molecular orbital (HOMO/ LUMO) energies were determined by Gaussian 09 W software using TD-DFT.

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