Geometry & MOs

Info

ID:	399054
PubChem CID:	135037360
Reduced:	ClO5H7C8 (1)
Stoich.:	AB5C7D8 (1)
Weight, g/mol:	188.069811
ΔH_f, kcal/mol:	-174.47
Dipole, Da:	3.97
IP(EA), eV:	-9.64(-1.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-5-pyridazin-4-yl-1H-pyridin-2-one

Drug info:

PubChemData

Smile

CCOC(=O)/C(=C/1\C=C(C(=O)O1)O)/Cl

DOS

IR

Vibrations