Geometry & MOs

Info

ID:	318514
PubChem CID:	126651593
Reduced:	N3O4C25H29 (1)
Stoich.:	A3B4C25D29 (1)
Weight, g/mol:	479.186336
ΔH_f, kcal/mol:	-86.81
Dipole, Da:	8.04
IP(EA), eV:	-8.15(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(2-chlorophenyl)phenoxy]-1-[4-(2,2-dimethylpropoxy)-3-methoxyphenyl]pyrrolidin-2-one

Drug info:

PubChemData

Smile

CC(C)(C)COC1=C(C=C(C=C1)N2CCC(C2=O)OC3=CC=C(C=C3)N4C=CN=C4)OC

DOS

IR

Vibrations