Geometry & MOs

Info

ID:	130126
PubChem CID:	51074988
Reduced:	SO2N3C15H15 (1)
Stoich.:	AB2C3D15E15 (1)
Weight, g/mol:	279.077454
ΔH_f, kcal/mol:	-17.9
Dipole, Da:	4.36
IP(EA), eV:	-8.96(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-chloro-4-methylphenyl)-N-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1=NCCS1)N2C(=C)C3=CC=CC=C3C2=O

DOS

IR

Vibrations