Geometry & MOs

Info

ID:	277373
PubChem CID:	103828124
Reduced:	N2O3C14H14 (1)
Stoich.:	A2B3C14D14 (1)
Weight, g/mol:	259.095691
ΔH_f, kcal/mol:	-93.0
Dipole, Da:	3.47
IP(EA), eV:	-8.95(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-hydroxy-2,4-dimethylphenyl)-6-oxo-1H-pyridazine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=C(C=C1)NC(=O)C2=CC(=O)NC=C2)C)O

DOS

IR

Vibrations