Geometry & MOs

Info

ID:	123745
PubChem CID:	50860628
Reduced:	IO2N3C23H28 (1)
Stoich.:	AB2C3D23E28 (1)
Weight, g/mol:	408.216141
ΔH_f, kcal/mol:	-25.32
Dipole, Da:	8.22
IP(EA), eV:	-8.0(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(Z)-(1-ethyl-2,2,4,7-tetramethyl-3,4-dihydroquinolin-6-yl)methylideneamino]-3-nitrobenzamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations