Geometry & MOs

Info

ID:	189425
PubChem CID:	77854112
Reduced:	SN3O8C17H27 (1)
Stoich.:	AB3C8D17E27 (1)
Weight, g/mol:	432.16787
ΔH_f, kcal/mol:	-365.5
Dipole, Da:	5.3
IP(EA), eV:	-9.72(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[5-amino-2-(ethylsulfonylamino)-5-oxopentanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid

Drug info:

PubChemData

Smile

CCS(=O)(=O)NC(CCC(=O)O)C(=O)N1CCCC1C(=O)N2CCCC2C(=O)O

DOS

IR

Vibrations