Geometry & MOs

Info

ID:	283969
PubChem CID:	104022800
Reduced:	SO2N4C14H18 (1)
Stoich.:	AB2C4D14E18 (1)
Weight, g/mol:	358.00991
ΔH_f, kcal/mol:	4.45
Dipole, Da:	4.65
IP(EA), eV:	-9.6(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-bromophenyl)-4-(2-methylpropyl)-1,2,4-triazole-3-sulfonamide

Drug info:

PubChemData

Smile

CC(C)CN1C(=NN=C1S(=O)(=O)N)C2CC3=CC=CC=C23

DOS

IR

Vibrations