Geometry & MOs

Info

ID:	123751
PubChem CID:	50860811
Reduced:	BrClON3C22H25 (1)
Stoich.:	ABCD3E22F25 (1)
Weight, g/mol:	432.09679
ΔH_f, kcal/mol:	-0.53
Dipole, Da:	7.14
IP(EA), eV:	-8.32(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-bromo-3-methylphenyl)-1-(7-chloro-1-ethyl-2,2,4-trimethyl-3,4-dihydroquinolin-6-yl)methanimine

Drug info:

PubChemData

Smile

CCN1C2=C(C=C(C(=C2)Cl)/C=N\NC(=O)C3=CC(=CC=C3)Br)C(CC1(C)C)C

DOS

IR

Vibrations