Geometry & MOs

Info

ID:	142663
PubChem CID:	53073118
Reduced:	SN3O5C21H25 (1)
Stoich.:	AB3C5D21E25 (1)
Weight, g/mol:	417.055005
ΔH_f, kcal/mol:	-170.45
Dipole, Da:	5.31
IP(EA), eV:	-9.74(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-chlorophenyl)-2-[3-(3-methylphenyl)sulfonyl-6-oxopyridazin-1-yl]acetamide

Drug info:

PubChemData

Smile

CCOC(=O)N1CCC(CC1)NC(=O)C2=CN=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)C

DOS

IR

Vibrations