Geometry & MOs

Info

ID:	21976
PubChem CID:	594490
Reduced:	N2O2Cl3F3H18C27 (1)
Stoich.:	A2B2C3D3E18F27 (1)
Weight, g/mol:	564.038595
ΔH_f, kcal/mol:	-132.17
Dipole, Da:	8.66
IP(EA), eV:	-9.15(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-chloro-1-[(3,4-dichlorophenyl)methylimino]-10-hydroxy-3-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-acridin-9-one

Drug info:

PubChemData

Smile

C1C(CC(=NCC2=CC(=C(C=C2)Cl)Cl)C3=C1N(C4=C(C3=O)C=C(C=C4)Cl)O)C5=CC(=CC=C5)C(F)(F)F

DOS

IR

Vibrations