Geometry & MOs

Info

ID:	366237
PubChem CID:	127319694
Reduced:	N2O3S3C13H14 (1)
Stoich.:	A2B3C3D13E14 (1)
Weight, g/mol:	365.084555
ΔH_f, kcal/mol:	-71.07
Dipole, Da:	7.96
IP(EA), eV:	-9.5(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,1-dioxothian-3-yl)-1-(4-fluorophenyl)-6-oxopyridazine-3-carboxamide

Drug info:

PubChemData

Smile

C1CC(CS(=O)(=O)C1)NC(=O)C2=CSC(=N2)C3=CC=CS3

DOS

IR

Vibrations