Geometry & MOs

Info

ID:	342793
PubChem CID:	127265956
Reduced:	SO2N3C13H17 (1)
Stoich.:	AB2C3D13E17 (1)
Weight, g/mol:	307.135448
ΔH_f, kcal/mol:	-29.27
Dipole, Da:	5.07
IP(EA), eV:	-9.42(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-tert-butyl-N-[2-(1H-pyrazol-4-yl)ethyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1S(=O)(=O)NCCC2=CNN=C2

DOS

IR

Vibrations