Geometry & MOs

Info

ID:	123925
PubChem CID:	50865627
Reduced:	FCl2O2N3H22C24 (1)
Stoich.:	AB2C2D3E22F24 (1)
Weight, g/mol:	366.174356
ΔH_f, kcal/mol:	-87.85
Dipole, Da:	4.29
IP(EA), eV:	-8.08(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(7-fluoro-1,2,2,4-tetramethylquinolin-6-yl)methylideneamino]-2-methylbenzoic acid

Drug info:

PubChemData

Smile

CC1=CC(N(C2=C1C=C(C(=C2)F)/C=C/3\C(=O)N(C(=O)N3)CC4=C(C=C(C=C4)Cl)Cl)C)(C)C

DOS

IR

Vibrations