Geometry & MOs

Info

ID:	36569
PubChem CID:	8008983
Reduced:	SN3O3C21H25 (1)
Stoich.:	AB3C3D21E25 (1)
Weight, g/mol:	399.161663
ΔH_f, kcal/mol:	-87.22
Dipole, Da:	3.91
IP(EA), eV:	-9.21(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-1-benzyl-N-ethyl-5-oxo-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]pyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CCN(CC(=O)NCC1=CC=CS1)C(=O)[C@@H]2CC(=O)N(C2)CC3=CC=CC=C3

DOS

IR

Vibrations