Geometry & MOs

Info

ID:	123711
PubChem CID:	50859573
Reduced:	ClFON3C24H25 (1)
Stoich.:	ABCD3E24F25 (1)
Weight, g/mol:	328.175105
ΔH_f, kcal/mol:	-40.89
Dipole, Da:	10.04
IP(EA), eV:	-8.48(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-fluorophenyl)-1-(7-fluoro-1,2,2,4-tetramethyl-3,4-dihydroquinolin-6-yl)methanimine

Drug info:

PubChemData

Smile

CC1CC(N(C2=C1C=C(C(=C2)F)/C=C(\C#N)/C(=O)NC3=C(C=CC(=C3)Cl)C)C)(C)C

DOS

IR

Vibrations