Geometry & MOs

Info

ID:	123813
PubChem CID:	50862638
Reduced:	Br2O2N3C24H29 (1)
Stoich.:	A2B2C3D24E29 (1)
Weight, g/mol:	412.15141
ΔH_f, kcal/mol:	-40.52
Dipole, Da:	8.17
IP(EA), eV:	-8.01(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations