Geometry & MOs

Info

ID:	290113
PubChem CID:	104410210
Reduced:	SN3O3C14H21 (1)
Stoich.:	AB3C3D14E21 (1)
Weight, g/mol:	283.099063
ΔH_f, kcal/mol:	-114.5
Dipole, Da:	4.71
IP(EA), eV:	-8.99(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)amino]-1,3-thiazol-4-yl]acetic acid

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(SC=N1)NC(C)C(=O)N2CCCCC2

DOS

IR

Vibrations