Geometry & MOs

Info

ID:	123729
PubChem CID:	50859791
Reduced:	ClFN2C21H24 (1)
Stoich.:	ABC2D21E24 (1)
Weight, g/mol:	401.226726
ΔH_f, kcal/mol:	-23.56
Dipole, Da:	6.89
IP(EA), eV:	-8.22(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(7-fluoro-1,2,2,4-tetramethyl-3,4-dihydroquinolin-6-yl)methylideneamino]-N-phenylaniline

Drug info:

PubChemData

Smile

CC1CC(N(C2=C1C=C(C(=C2)F)C=NC3=C(C=CC(=C3)Cl)C)C)(C)C

DOS

IR

Vibrations