Geometry & MOs

Info

ID:	352464
PubChem CID:	127283552
Reduced:	S2N3O4C13H19 (1)
Stoich.:	A2B3C4D13E19 (1)
Weight, g/mol:	366.226705
ΔH_f, kcal/mol:	-106.77
Dipole, Da:	9.5
IP(EA), eV:	-8.12(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-acetyl-N-[2-[(1-acetylpyrrolidine-2-carbonyl)amino]butyl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=NO1)NC(=O)C(C)SCC(=O)N2CCS(=O)CC2

DOS

IR

Vibrations