Geometry & MOs

Info

ID:	267019
PubChem CID:	103580475
Reduced:	FSCl2N2O2H7C13 (1)
Stoich.:	ABC2D2E2F7G13 (1)
Weight, g/mol:	322.969831
ΔH_f, kcal/mol:	-52.76
Dipole, Da:	1.83
IP(EA), eV:	-10.12(-1.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,5-dichloro-4-fluorophenyl)-5-methyl-1H-pyrazole-4-sulfonamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C#N)S(=O)(=O)NC2=CC(=C(C(=C2)Cl)F)Cl

DOS

IR

Vibrations