Geometry & MOs

Info

ID:	208264
PubChem CID:	80508843
Reduced:	O2N5C11H19 (1)
Stoich.:	A2B5C11D19 (1)
Weight, g/mol:	228.081124
ΔH_f, kcal/mol:	-30.95
Dipole, Da:	5.54
IP(EA), eV:	-9.18(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-fluoro-2-methylanilino)pyridazine-4-carbonitrile

Drug info:

PubChemData

Smile

CN(CC(=O)NCCOC)C1=C(C=CN=N1)CN

DOS

IR

Vibrations