Geometry & MOs

Info

ID:	123757
PubChem CID:	50860914
Reduced:	ClON3C26H30 (1)
Stoich.:	ABC3D26E30 (1)
Weight, g/mol:	364.215078
ΔH_f, kcal/mol:	-7.8
Dipole, Da:	9.05
IP(EA), eV:	-8.14(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-benzodioxol-5-yl)-1-(1-ethyl-2,2,4,7-tetramethyl-3,4-dihydroquinolin-6-yl)methanimine

Drug info:

PubChemData

Smile

CCN1C2=C(C=C(C(=C2)C)/C=C(\C#N)/C(=O)NC3=C(C=CC(=C3)Cl)C)C(CC1(C)C)C

DOS

IR

Vibrations