de Oliveira, Marcelo T.’s team published research in ARKIVOC (Gainesville, FL, United States) in | CAS: 930-36-9

ARKIVOC (Gainesville, FL, United States) published new progress about 930-36-9. 930-36-9 belongs to pyrazoles-derivatives, auxiliary class Pyrazole, name is 1-Methylpyrazole, and the molecular formula is C4H6N2, Recommanded Product: 1-Methylpyrazole.

de Oliveira, Marcelo T. published the artcilePrediction of 15N NMR chemical shifts for nitrogenated aromatic compounds, Recommanded Product: 1-Methylpyrazole, the publication is ARKIVOC (Gainesville, FL, United States) (2020), 113-122, database is CAplus.

Building on recent developments, we compare performance of two distinct protocols, namely SMD-mPW1PW91/6-311+G(2d,p) and CPCM-OLYP/pcSseg-2, for the computation of 15N chem. shifts of nitrogenated aromatic compounds The latter shows best overall performance (MAD 5.3 ppm) albeit results in chloroform favors the former.

ARKIVOC (Gainesville, FL, United States) published new progress about 930-36-9. 930-36-9 belongs to pyrazoles-derivatives, auxiliary class Pyrazole, name is 1-Methylpyrazole, and the molecular formula is C4H6N2, Recommanded Product: 1-Methylpyrazole.

Referemce:
https://en.wikipedia.org/wiki/Pyrazole,
Pyrazoles – an overview | ScienceDirect Topics