Geometry & MOs

Info

ID:	78916
PubChem CID:	49742700
Reduced:	NOC7H7 (3)
Stoich.:	ABC7D7 (3)
Weight, g/mol:	406.189257
ΔH_f, kcal/mol:	-87.12
Dipole, Da:	5.64
IP(EA), eV:	-8.95(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(2-oxo-4-propan-2-yl-1H-quinolin-7-yl)acetamide

Drug info:

PubChemData

Smile

CC(C)C1=CC(=O)NC2=C1C=CC(=C2)NC(=O)CNC(=O)C3=CC=CC=C3

DOS

IR

Vibrations