Geometry & MOs

Info

ID:	342553
PubChem CID:	127265708
Reduced:	NO2C23H27 (1)
Stoich.:	AB2C23D27 (1)
Weight, g/mol:	339.107519
ΔH_f, kcal/mol:	-71.6
Dipole, Da:	3.62
IP(EA), eV:	-9.3(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-N-[2-(4-tert-butyl-1,3-thiazol-2-yl)ethyl]benzenesulfonamide

Drug info:

PubChemData

Smile

C1CC(C2=CC=CC=C2C1)CC(=O)N3CCC(CC3)(C4=CC=CC=C4)O

DOS

IR

Vibrations