Geometry & MOs

Info

ID:	283956
PubChem CID:	104022586
Reduced:	ClSO2N4C10H11 (1)
Stoich.:	ABC2D4E10F11 (1)
Weight, g/mol:	324.030409
ΔH_f, kcal/mol:	-18.57
Dipole, Da:	5.24
IP(EA), eV:	-9.74(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[4-fluoro-3-(trifluoromethyl)phenyl]-4-methyl-1,2,4-triazole-3-sulfonamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C2=NN=C(N2C)S(=O)(=O)N)Cl

DOS

IR

Vibrations