Geometry & MOs

Info

ID:	276399
PubChem CID:	103823017
Reduced:	BrClSN2O2H8C13 (1)
Stoich.:	ABCD2E2F8G13 (1)
Weight, g/mol:	291.107519
ΔH_f, kcal/mol:	9.18
Dipole, Da:	4.48
IP(EA), eV:	-9.76(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[1-(2,5-dimethyl-1,3-thiazol-4-yl)ethylamino]propyl]methanesulfonamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C#N)S(=O)(=O)NC2=CC(=C(C=C2)Br)Cl

DOS

IR

Vibrations