Geometry & MOs

Info

ID:	66477
PubChem CID:	46504648
Reduced:	N4O4C19H20 (1)
Stoich.:	A4B4C19D20 (1)
Weight, g/mol:	379.171834
ΔH_f, kcal/mol:	-14.0
Dipole, Da:	4.76
IP(EA), eV:	-8.18(-1.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-[2-(diethylamino)-4-methylquinolin-6-yl]-3-(3-methylthiophen-2-yl)prop-2-enamide

Drug info:

PubChemData

Smile

CCN(CC)C1=NC2=C(C=C(C=C2)NC(=O)C3=CC=C(O3)[N+](=O)[O-])C(=C1)C

DOS

IR

Vibrations