Geometry & MOs

Info

ID:	268581
PubChem CID:	103600070
Reduced:	FNO3H14C15 (1)
Stoich.:	ABC3D14E15 (1)
Weight, g/mol:	274.025753
ΔH_f, kcal/mol:	-139.99
Dipole, Da:	4.12
IP(EA), eV:	-9.55(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-chloro-2-cyanophenyl)-6-oxo-1H-pyridazine-3-carboxamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations