Geometry & MOs

Info

ID:	343122
PubChem CID:	127266295
Reduced:	NSO4C16H19 (1)
Stoich.:	ABC4D16E19 (1)
Weight, g/mol:	343.07574
ΔH_f, kcal/mol:	-129.98
Dipole, Da:	6.97
IP(EA), eV:	-9.56(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-chloro-3-(hydroxymethyl)phenyl]-1-ethyl-3,5-dimethylpyrazole-4-sulfonamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)CCO

DOS

IR

Vibrations