Geometry & MOs

Info

ID:	340004
PubChem CID:	127262013
Reduced:	O3N4C16H30 (1)
Stoich.:	A3B4C16D30 (1)
Weight, g/mol:	328.156912
ΔH_f, kcal/mol:	-173.08
Dipole, Da:	7.45
IP(EA), eV:	-9.29(0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-(2-amino-2-oxoethyl)-1-[(2S)-pyrrolidine-2-carbonyl]-N-(2-sulfanylethyl)pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CCCN(CC(=O)N)C(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1

DOS

IR

Vibrations