Geometry & MOs

Info

ID:	162756
PubChem CID:	57566695
Reduced:	ClFSN2O5H20C23 (1)
Stoich.:	ABCD2E5F20G23 (1)
Weight, g/mol:	450.134635
ΔH_f, kcal/mol:	-174.53
Dipole, Da:	7.35
IP(EA), eV:	-9.32(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-[3-(5-chloro-2-methylphenoxy)-4-methoxyphenyl]-2-oxopyrrolidin-1-yl]benzamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)F)OC2=C(C=CC(=C2)Cl)[C@H]3CC(=O)N(C3)C4=CC=C(C=C4)S(=O)(=O)N

DOS

IR

Vibrations