Geometry & MOs

Info

ID:	200364
PubChem CID:	79377111
Reduced:	SN2O3C15H20 (1)
Stoich.:	AB2C3D15E20 (1)
Weight, g/mol:	297.168856
ΔH_f, kcal/mol:	-87.49
Dipole, Da:	2.78
IP(EA), eV:	-9.15(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-1-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)carbamoyl]pyrrolidine-3-carboxylic acid

Drug info:

PubChemData

Smile

CC1C(CCN1C(=O)N(CC2=CSC=C2)C3CC3)C(=O)O

DOS

IR

Vibrations