Geometry & MOs

Info

ID:	208241
PubChem CID:	80508281
Reduced:	O2N5H9C14 (1)
Stoich.:	A2B5C9D14 (1)
Weight, g/mol:	298.125218
ΔH_f, kcal/mol:	49.37
Dipole, Da:	1.63
IP(EA), eV:	-9.66(-1.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,6-diethyl-3-(4-methylsulfanylanilino)pyridazine-4-carbonitrile

Drug info:

PubChemData

Smile

CN1C(=O)C2=C(C1=O)C=C(C=C2)NC3=C(C=CN=N3)C#N

DOS

IR

Vibrations