Geometry & MOs

Info

ID:	26676
PubChem CID:	794568
Reduced:	NOC8H8 (2)
Stoich.:	ABC8D8 (2)
Weight, g/mol:	233.105193
ΔH_f, kcal/mol:	-10.16
Dipole, Da:	6.72
IP(EA), eV:	-8.56(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (3R,4S)-4-(4-methylphenyl)-2-oxopyrrolidine-3-carboxylate

Drug info:

PubChemData

Smile

CCC(=NNC(=O)C1=CC=CC=C1)C2=CC=C(C=C2)O

DOS

IR

Vibrations