Geometry & MOs

Info

ID:	81643
PubChem CID:	49854956
Reduced:	N3H11C16 (1)
Stoich.:	A3B11C16 (1)
Weight, g/mol:	275.105862
ΔH_f, kcal/mol:	120.61
Dipole, Da:	5.56
IP(EA), eV:	-8.71(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=CN2)/C=C(\C#N)/C3=CN=CC=C3

DOS

IR

Vibrations