Geometry & MOs

Info

ID:	58310
PubChem CID:	24697673
Reduced:	OF2N2C13H16 (1)
Stoich.:	AB2C2D13E16 (1)
Weight, g/mol:	159.079647
ΔH_f, kcal/mol:	-121.24
Dipole, Da:	2.97
IP(EA), eV:	-9.02(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(prop-2-enylamino)pyridine-3-carbonitrile

Drug info:

PubChemData

Smile

C1CCNC(C1)CNC(=O)C2=C(C=CC(=C2)F)F

DOS

IR

Vibrations