Geometry & MOs

Info

ID:	284861
PubChem CID:	104078556
Reduced:	SN2O3C13H16 (1)
Stoich.:	AB2C3D13E16 (1)
Weight, g/mol:	211.077933
ΔH_f, kcal/mol:	-76.34
Dipole, Da:	4.29
IP(EA), eV:	-9.99(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-1-ethyl-5-(1,3-thiazol-2-yl)pyrrolidin-2-one

Drug info:

PubChemData

Smile

C1CC(C(N(C(=O)C1)C2CC2)C3=CN=CS3)C(=O)O

DOS

IR

Vibrations