Geometry & MOs

Info

ID:	123709
PubChem CID:	50859571
Reduced:	FOSN3C25H28 (1)
Stoich.:	ABCD3E25F28 (1)
Weight, g/mol:	360.140469
ΔH_f, kcal/mol:	-37.8
Dipole, Da:	2.93
IP(EA), eV:	-8.04(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-2-[(7-fluoro-1,2,2,4-tetramethyl-3,4-dihydroquinolin-6-yl)methylideneamino]phenol

Drug info:

PubChemData

Smile

CC1CC(N(C2=C1C=C(C(=C2)F)/C=C/3\C(=O)N=C(S3)NC4=CC=CC(=C4C)C)C)(C)C

DOS

IR

Vibrations