Geometry & MOs

Info

ID:	273879
PubChem CID:	103805568
Reduced:	OSN3C14H17 (1)
Stoich.:	ABC3D14E17 (1)
Weight, g/mol:	213.147727
ΔH_f, kcal/mol:	4.15
Dipole, Da:	4.65
IP(EA), eV:	-8.9(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-[3-(ethylamino)propyl]-5-oxopyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CCNCC1=CC=CC=C1NC(=O)C2=CN=C(S2)C

DOS

IR

Vibrations