Hydrolysis of N-Sulfinylamines and Isocyanates:  A Computational Comparison

EV Ivanova, HM Muchall - The Journal of Physical Chemistry A, 2007 - ACS Publications
A comparative study of the concerted hydrolysis of H-, CF3-, CH3-, and Ph-substituted N-
sulfinylamines (R− NSO) and isocyanates (R− NCO) was performed using B3LYP/6-31+ G …

NMR of terminal oxygen. Part 12. SO 2 and isoelectronic compounds with a true π-bond: 17 O NMR spectra of sulfinylamines R–N [double bond, length half m-dash] S …

H Dahn, P Péchy, V Van Toan, BF Bonini… - Journal of the …, 1993 - pubs.rsc.org
The 17O NMR shift values δo of 20 sulfinylamines R–NSO 2 and of 14 sulfines RR′ CSO 3
(R and R′ mostly arene groups) were compared with those of the isoelectronic SO21. They …

Spectroscopic and structural properties of N-sulfinyl-benzenamine, OSN–C6H5

RM Romano, CO Della Védova… - Journal of molecular …, 1999 - Elsevier
N-sulfinyl-benzeneamine, O S N–C6H5, was studied by spectroscopic and quantum
chemical methods. It was shown that the ground state exhibits a planar structure with a Z …

Synthesis and characterization of o-fluorosulfinylaniline. A comparative vibrational study of fluorinated sulfinylaniline series

ALP Jerez, DJA de Armiño, NL Robles - New Journal of Chemistry, 2015 - pubs.rsc.org
The synthesis of o-fluorosulfinylaniline is reported with the aim to complete the fluorinated
sulfinylaniline series. The FT-IR and Raman spectra of o-fluorosulfinylaniline are recorded …

From Inert to Explosive, The Hydrolytic Reactivity of R− NSO Compounds Understood: A Computational Study

EV Ivanova, HM Muchall - The Journal of Physical Chemistry A, 2011 - ACS Publications
We present a computational study on the concerted hydrolysis of several classes of N-
sulfinylamines of generic formula R− N S O, such as the-amines themselves (R− NSO) …

Molecular structure and properties of N, N'-disulfinyl-1, 2-diaminobenzene

IY Bagryanskaya, YV Gatilov, AY Makarov… - Russian journal of …, 2001 - Springer
According to X-ray diffraction data, N, N'-disulfinyl-1, 2-diaminobenzene in crystal exists as a
planar Z, Z isomer. On heating or under the action of catalytic amounts of water, as well as in …

Synthesis and experimental and theoretical characterization of m-fluorosulfinylaniline

ALP Jerez, DM Chemes, EH Cutin… - New Journal of …, 2015 - pubs.rsc.org
The synthesis of m-fluorosulfinylaniline together with a tentative assignment of the
vibrational, NMR and mass spectra are reported. Quantum chemical calculations predict two …

[PDF][PDF] The sulfur–oxygen bond in sulfinylamines and sulfinylhydrazines: an AIM study

HM Muchall - Arkivoc, 2001 - arkat-usa.org
The quantum theory of “atoms in molecules”(AIM) has been employed for an investigation of
the sulfur–oxygen bond in CH3–NSO and CH3–NH–NSO. A comparison with the SO bond …

Oxygen‐17 and carbon‐13 NMR studies of diarylketenes

G Cerioni, A Plumitallo, J Frey… - Magnetic resonance in …, 1995 - Wiley Online Library
Natural abundance 17O and 13C NMR spectra for eleven diarylketenes are reported. 17O
shifts show invariance with para substitution and a shielding due to ortho substitution. A …

On the search of the influence of substituents in the structural and vibrational properties of p-substituted sulfinylanilines: Study of p-trifluoromethylsulfinylaniline

DM Chemes, EH Cutin, RMS Álvarez, NL Robles… - Journal of Fluorine …, 2018 - Elsevier
The study of substitution effects on the structural and vibrational properties of para
substituted sulfinylanilines proceeds a step forward with the study of p …