Electronic absorption, vibrational spectra, nonlinear optical properties, NBO analysis and thermodynamic properties of N-(4-nitro-2-phenoxyphenyl) …

T Rajamani, S Muthu, M Karabacak - Spectrochimica Acta Part A …, 2013 - Elsevier
In this work, the vibrational spectral analysis was carried out by using FT-Raman and FT-IR
spectroscopy in the range 4000–100 cm− 1 and 4000–400 cm− 1, respectively, for N-(4-nitro …

DFT based computational study on the molecular conformation, NMR chemical shifts and vibrational transitions for N-(2-methylphenyl) methanesulfonamide and N-(3 …

M Karabacak, M Cinar, M Kurt - Journal of Molecular Structure, 2010 - Elsevier
This paper presents a DFT quantum chemical investigation of the molecular conformation,
NMR chemical shifts and vibrational transitions of N-(2-methylphenyl) methanesulfonamide …

Combined experimental and theoretical studies on the chemical and spectroscopic properties of an antimicrobial N-(Phenyl) dimethyldisulfonimide

B Eren, A Ünal, F Özdemir-Koçak - Journal of Molecular Structure, 2019 - Elsevier
A disulfonimide derivative, N-(phenyl) dimethyldisulfonimide, was synthesized by two-step
sulfonation of aniline with methane sulfonyl chloride. Antimicrobial activity of the molecule …

Carbon–phosphorus bond formation on anilines mediated by a hypervalent iodine reagent

E Deruer, S Coulibali, S Boukercha… - The Journal of Organic …, 2017 - ACS Publications
Substituted anilines containing a sulfonyl group may be oxidized in situ in the presence of
methanol and a hypervalent iodine reagent to form an active iminium species. Subsequent …

Synthesis, characterization, computational studies, antimicrobial activities and carbonic anhydrase inhibitor effects of 2-hydroxy acetophenone-N-methyl p …

N Özbek, S Alyar, BK Memmi, AB Gündüzalp… - Journal of Molecular …, 2017 - Elsevier
Hydroxyacetophenone-N-methyl p-toluenesulfonylhydrazone (afptsmh) derived from p-
toluenesulfonicacid-1-methylhydrazide (ptsmh) and its Co (II), Pd (II), Pt (II) complexes were …

Synthesis, characterization and antimicrobial activity of m-toluenesulfonamide, N, N′-1, 2-ethanediylbis (mtsen) and [Cu (II)(phenanthroline) 2] mtsen complex

H Alyar, S Alyar, A Ünal, N Özbek, E Şahin… - Journal of Molecular …, 2012 - Elsevier
M-toluenesulfonamide, N, N′-1, 2-ethanediylbis (a disulfonamide compound, mtsen) and
[Cu (II)(phenanthroline) 2] mtsen compounds were newly synthesized. The molecular …

Promising Functional Structural Building Unit Trisulfimide (SO2N)33– and Its Contributions to Second Harmonic Generation and Birefringence

CF Zhu, X Liu, RX Wang, LM Wu… - Crystal Growth & Design, 2024 - ACS Publications
A new functional structural building unit, trisulfimide ion (SO2N) 33–, is reported. Its
contributions to enhance the second harmonic generation (SHG) and birefringence (Δ n) are …

Determination of structural and vibrational spectroscopic properties of 2-, 3-, 4-nitrobenzenesulfonamide using FT-IR and FT-Raman experimental techniques and …

M Karabacak, E Postalcilar, M Cinar - Spectrochimica Acta Part A …, 2012 - Elsevier
In this work, the molecular conformation and vibrational analysis of 2-, 3-, 4-
nitrobenzenesulfonamide (abbreviated as 2-, 3-, 4-NBSA) were presented for the ground …

Molecular structure, spectroscopic characterization (FT-IR, FT-Raman, UV and NMR), HOMO and LUMO analysis of 3-ethynylthiophene with DFT quantum chemical …

M Karabacak, S Bilgili, T Mavis, M Eskici… - Spectrochimica Acta Part A …, 2013 - Elsevier
In this work, FT-IR, FT-Raman, UV and NMR spectra of 3-ethynylthiophene (3-ETP, C 6 H 4
S) were carried out by using density functional theory DFT/B3LYP method with the 6-311++ …

Efficient continuous-flow bromination of methylsulfones and methanesulfonates and continuous synthesis of hypobromite

FEA Van Waes, S Seghers, W Dermaut… - Journal of Flow …, 2014 - akjournals.com
An efficient continuous-flow procedure for the synthesis of tribromomethylsulfones and
tribromomethanesulfonates has been developed starting from the corresponding …