Geometry & MOs

Info

ID:	187520
PubChem CID:	77583892
Reduced:	ClO2F4N4H15C19 (1)
Stoich.:	AB2C4D4E15F19 (1)
Weight, g/mol:	468.265589
ΔH_f, kcal/mol:	-209.38
Dipole, Da:	7.84
IP(EA), eV:	-9.77(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[5-[(6-chloro-1,2,3,4-tetrahydroacridin-9-yl)amino]pentylamino]-3,4,4a,5,6,7,8,8a-octahydro-1H-quinolin-2-one

Drug info:

PubChemData

Smile

CN1C2C(C(=O)NC(N2)OC3=CC=CC(=C3F)C(F)(F)F)N=C1C4=CC=C(C=C4)Cl

DOS

IR

Vibrations