Geometry & MOs

Info

ID:	153636
PubChem CID:	56312911
Reduced:	SN2O6C23H30 (1)
Stoich.:	AB2C6D23E30 (1)
Weight, g/mol:	350.199428
ΔH_f, kcal/mol:	-203.63
Dipole, Da:	8.1
IP(EA), eV:	-9.27(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-methylphenyl)-5-oxo-N-(3-phenylbutyl)pyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(CCNC(=O)C1=C(C(=CC(=C1)S(=O)(=O)N2CCOCC2)OC)OC)C3=CC=CC=C3

DOS

IR

Vibrations