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Correction: Role of solute-solvent hydrogen bonds on the ground state and the excited state proton transfer in 3-hydroxyflavone. A systematic spectrophotometric study

Simone Lazzaroni ab, Daniele Dondi a, Alberto Mezzetti *c and Stefano Protti *d
aRadchem Lab, Department of Chemistry, University of Pavia, Via Taramelli 10, Italy
bLaboratory of Applied Nuclear Energy, LENA, University of Pavia, Via Aselli 41, 27100 Pavia, Italy
cLaboratoire de Réactivité de Surface UMR CNRS 7197, Sorbonne Université, Faculté de Sciences et Ingénierie, Tour 43-53, 3ème étage, 4 Pl Jussieu, 75005 Paris, France. E-mail: alberto.mezzetti@upmc.fr
dPhotoGreen Lab, Department of Chemistry, University of Pavia, Via Taramelli 12, 27100 Pavia, Italy. E-mail: stefano.protti@unipv.it

Received 11th May 2020 , Accepted 11th May 2020

First published on 29th May 2020


Abstract

Correction for ‘Role of solute-solvent hydrogen bonds on the ground state and the excited state proton transfer in 3-hydroxyflavone. A systematic spectrophotometric study’ by Simone Lazzaroni et al., Photochem. Photobiol. Sci., 2018, 17, 923–933, DOI: 10.1039/C8PP00053K.


The authors would like to correct Table 1 as, upon further examination of the fluorescence spectra and fluorescence excitation spectra, they noticed that the position of the peak is not well-defined. This may be due to a series of factors: (1) simultaneous presence, in the same solution, of three different emission peaks (N*, T*, A*). The authors decided not to use any deconvolution or band decomposition procedure for reasons that will be explained in point (3) below. This may lead to some uncertainty (±∼3 nm) especially when the A* band is present. (2) Presence of Raman peak(s) from the solvent which overlap with the emission peaks, leading to some uncertainty around the exact position of the latter. (3) Presence of subpopulations of species (especially of the A* form, as previously noticed),1,2 each one characterized by slightly different emission and absorption peaks.
Table 1 Photophysical parameters for 3HF in different solvents. In parenthesis, the quantum yields are indicated
Solvent λ em(N) (ΦN) λ em(T) (ΦT) λ em(A) (ΦA) λ ex(A)
Aqueous solution
NaOH (0.1 M) 519 (0.002) 400
 
Alkanes
n-Pentane 530 (0.37)
i-Pentane 528 (0.32)
2,2,4-Trimethylpentane 523 (0.31)
n-Hexane 529 (0.33)
Cyclohexane 527 (0.28)
 
Aromatics
Benzene 536 (0.23)
Toluene 530 (0.29)
 
Haloaliphatics
Dichloromethane 528 (0.18)
Chloroform 400 (<10−3) 532 (0.19)
Carbon tetrachloride 523 (0.24)
 
Esters
Ethyl acetate 387 (0.0027) 529 (0.067)
 
Nitriles
Acetonitrile 395 (0.0008) 525 (0.06) 468 (0.096) 420
 
Ethers
1,4-Dioxane 394 (0.0028) 530 (0.067) 474 (0.055) 413
Diethyl ether 400 (0.0025) 537 (0.042) 474 (0.052) 412
Tetrahydrofuran 403 (0.001) 538 (0.040) 485 (0.119) 404
 
Ketones
Acetone 400 (0.0048) 530 (0.030) 481 (0.046) 420
 
Alcohols
Methanol 406 (0.009) 528 (0.017) 481 (0.029) 410
Ethanol 406 (0.0056) 531 (0.018) 478 (0.010) 414
i-Propanol 404 (0.0049) 532 (0.041) 495 (0.021) 411
2-Methoxyethanol 403 (0.009) 539 (0.053) 488 (0.018) 406
Triethylene glycol monomethyl ether 406 (0.0079) 540 (0.067) 484 (0.053) 411
2,2,2-Trifluoroethanol 407 (0.024) 503 (0.046)
 
Amides
Formamide 406 (0.006) 526 (0.023) 490 (0.016) 412
N-Methylformamide 402 (0.009) 529 (0.035) 483 (0.130) 407
N,N-Dimethylformamide 400 (0.003) 539 (0.024) 492 (0.096) 431 (a twin peak at 417 nm)
 
Sulfoxides
Dimethylsulfoxide 400 (0.0015) 534 (0.008) 502 (0.034) 428


Slight discrepancies compared to literature values are most likely due to differences in the excitation wavelength (for the emission spectra) or the chosen emission wavelength (for the fluorescence excitation spectra). Given the strict protocols which were followed for solvent purification and 3HF purification, the authors exclude any contributions from impurities, moisture, or other contaminants.

The correct Table 1 is shown below with the corrected values for the following: λem(N) in ethyl acetate, acetonitrile, 1,4-dioxane, tetrahydrofuran, methanol, formamide and N-methyl formamide; λem(T) in chloroform; λem(A) in acetone, ethanol and formamide; and λex(A) in tetrahydrofuran, acetone, methanol, iso-propanol, 2-methoxyethanol, formamide, N-methylformamide and N,N-dimethylformamide.

The Royal Society of Chemistry apologises for these errors and any consequent inconvenience to authors and readers.

References

  1. D. Loco, S. Protti, B. Mennucci and A. Mezzetti, J. Mol. Struct., 2019, 1182, 283–291 Search PubMed.
  2. B. Dereka, R. Letrun, D. Svechkarev, A. Rosspeintner and E. Vauthey, J. Phys. Chem. B, 2015, 119, 2434–2443 Search PubMed.

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