Geometry & MOs

Info

ID:	264737
PubChem CID:	103486799
Reduced:	NO2C16H27 (1)
Stoich.:	AB2C16D27 (1)
Weight, g/mol:	255.104148
ΔH_f, kcal/mol:	-98.84
Dipole, Da:	1.88
IP(EA), eV:	-9.08(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-[(1-methylpyrrolidin-3-yl)amino]-1,3-thiazol-4-yl]propanoic acid

Drug info:

PubChemData

Smile

CCC(C(C1=CC=CC=C1C)OC(C)COCC)N

DOS

IR

Vibrations