Geometry & MOs

Info

ID:	81542
PubChem CID:	49854846
Reduced:	ON3H17C23 (1)
Stoich.:	AB3C17D23 (1)
Weight, g/mol:	334.131742
ΔH_f, kcal/mol:	108.52
Dipole, Da:	5.95
IP(EA), eV:	-8.45(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-3-(3,5-dimethoxyphenyl)-2-(5-methoxy-1H-indol-3-yl)prop-2-enenitrile

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COC2=CC3=C(C=C2)NC=C3/C(=C/C4=CN=CC=C4)/C#N

DOS

IR

Vibrations