Geometry & MOs

Info

ID:	208357
PubChem CID:	80523153
Reduced:	OSN3H11C13 (1)
Stoich.:	ABC3D11E13 (1)
Weight, g/mol:	244.040341
ΔH_f, kcal/mol:	76.17
Dipole, Da:	3.32
IP(EA), eV:	-8.94(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-3-chloro-3-(5-methylfuran-2-yl)-2-pyridin-3-ylprop-2-enenitrile

Drug info:

PubChemData

Smile

CC1=CSC=C1C2=NOC(=C2C3=CN=CC=C3)N

DOS

IR

Vibrations