Geometry & MOs

Info

ID:	21236
PubChem CID:	587758
Reduced:	O3N4H10C12 (1)
Stoich.:	A3B4C10D12 (1)
Weight, g/mol:	258.07529
ΔH_f, kcal/mol:	-17.73
Dipole, Da:	4.48
IP(EA), eV:	-8.96(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-hydroxyphenyl)methylideneamino]-6-oxo-1H-pyridazine-3-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C=NNC(=O)C2=NNC(=O)C=C2)O

DOS

IR

Vibrations