Geometry & MOs

Info

ID:	283852
PubChem CID:	104012759
Reduced:	FN3H12C15 (1)
Stoich.:	AB3C12D15 (1)
Weight, g/mol:	239.105862
ΔH_f, kcal/mol:	42.45
Dipole, Da:	6.53
IP(EA), eV:	-9.3(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-3-amino-3-(5-ethylfuran-2-yl)-2-pyridin-3-ylprop-2-enenitrile

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)F)/C(=C(/C#N)\C2=CN=CC=C2)/N

DOS

IR

Vibrations