Geometry & MOs

Info

ID:	123819
PubChem CID:	50862644
Reduced:	BrON3C24H30 (1)
Stoich.:	ABC3D24E30 (1)
Weight, g/mol:	378.230728
ΔH_f, kcal/mol:	-18.88
Dipole, Da:	3.2
IP(EA), eV:	-7.9(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(2,2,4,7-tetramethyl-1-propyl-3,4-dihydroquinolin-6-yl)methylideneamino]benzoic acid

Drug info:

PubChemData

Smile

CCCN1C2=C(C=C(C(=C2)C)/C=N\NC(=O)C3=CC=CC=C3Br)C(CC1(C)C)C

DOS

IR

Vibrations