Geometry & MOs

Info

ID:	264725
PubChem CID:	103486248
Reduced:	SO2N4C12H16 (1)
Stoich.:	AB2C4D12E16 (1)
Weight, g/mol:	321.081698
ΔH_f, kcal/mol:	-22.66
Dipole, Da:	5.58
IP(EA), eV:	-8.32(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-[2-[2-(methanesulfonamido)ethylamino]-1,3-thiazol-4-yl]propanoate

Drug info:

PubChemData

Smile

CCOC(=O)CCC1=CSC(=N1)NC2=CN(N=C2)C

DOS

IR

Vibrations