Geometry & MOs

Info

ID:	172850
PubChem CID:	75560391
Reduced:	F3O3N4H17C20 (1)
Stoich.:	A3B3C4D17E20 (1)
Weight, g/mol:	413.187005
ΔH_f, kcal/mol:	-110.46
Dipole, Da:	12.18
IP(EA), eV:	-8.68(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-chlorophenoxy)-N-[(1,2,2,4,7-pentamethyl-3,4-dihydroquinolin-6-yl)methylideneamino]acetamide

Drug info:

PubChemData

Smile

CC1=CC(=CN1C2=CC=C(C=C2)OC)C=NNC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

DOS

IR

Vibrations