Geometry & MOs

Info

ID:	343075
PubChem CID:	127266248
Reduced:	SO2N4C14H20 (1)
Stoich.:	AB2C4D14E20 (1)
Weight, g/mol:	336.161997
ΔH_f, kcal/mol:	-23.99
Dipole, Da:	8.35
IP(EA), eV:	-9.52(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-tert-butyl-N-[3-(4-methyl-1,2,4-triazol-3-yl)propyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1S(=O)(=O)NCCCC2=NN=CN2C

DOS

IR

Vibrations