Geometry & MOs

Info

ID:	78917
PubChem CID:	49742701
Reduced:	NO2C12H13 (2)
Stoich.:	AB2C12D13 (2)
Weight, g/mol:	322.131742
ΔH_f, kcal/mol:	-138.85
Dipole, Da:	7.52
IP(EA), eV:	-8.77(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-(furan-2-yl)-N-(2-oxo-4-propan-2-yl-1H-quinolin-7-yl)prop-2-enamide

Drug info:

PubChemData

Smile

CC(C)C1=CC(=O)NC2=C1C=CC(=C2)NC(=O)COC3=CC=CC4=C3OC(C4)(C)C

DOS

IR

Vibrations