Geometry & MOs

Info

ID:	129011
PubChem CID:	51066330
Reduced:	ClN2O2H17C21 (1)
Stoich.:	AB2C2D17E21 (1)
Weight, g/mol:	396.132136
ΔH_f, kcal/mol:	-11.35
Dipole, Da:	2.07
IP(EA), eV:	-8.91(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5,6-dimethoxy-3-oxo-1H-2-benzofuran-4-yl)-2-(2-oxopyrrolidin-1-yl)benzamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(C(=O)N2CC3=CC=C(C=C3)Cl)(CC4=CC=CC=N4)O

DOS

IR

Vibrations