Geometry & MOs

Info

ID:	49005
PubChem CID:	11528605
Reduced:	FON2H7C12 (1)
Stoich.:	ABC2D7E12 (1)
Weight, g/mol:	214.074228
ΔH_f, kcal/mol:	13.31
Dipole, Da:	5.78
IP(EA), eV:	-9.55(-1.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-oxo-1H-pyridin-3-yl)benzamide

Drug info:

PubChemData

Smile

C1COC2=C(C1=C(C#N)C#N)C=C(C=C2)F

DOS

IR

Vibrations