Geometry & MOs

Info

ID:	14777
PubChem CID:	420404
Reduced:	NO3C20H21 (1)
Stoich.:	AB3C20D21 (1)
Weight, g/mol:	323.152144
ΔH_f, kcal/mol:	-53.65
Dipole, Da:	2.8
IP(EA), eV:	-7.78(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(6-ethoxy-1-methyl-2H-quinolin-2-yl)ethenyl]benzene-1,2-diol

Drug info:

PubChemData

Smile

CCOC1=CC2=C(C=C1)N(C(C=C2)C=CC3=CC(=C(C=C3)O)O)C

DOS

IR

Vibrations