Geometry & MOs

Info

ID:	81349
PubChem CID:	49854629
Reduced:	ON3H15C18 (1)
Stoich.:	AB3C15D18 (1)
Weight, g/mol:	303.137162
ΔH_f, kcal/mol:	74.56
Dipole, Da:	7.08
IP(EA), eV:	-8.35(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-2-(5-propan-2-yloxy-1H-indol-3-yl)-3-pyridin-3-ylprop-2-enenitrile

Drug info:

PubChemData

Smile

CCOC1=CC2=C(C=C1)NC=C2/C(=C/C3=CN=CC=C3)/C#N

DOS

IR

Vibrations