Geometry & MOs

Info

ID:	283921
PubChem CID:	104020743
Reduced:	ISO2N4C11H13 (1)
Stoich.:	ABC2D4E11F13 (1)
Weight, g/mol:	359.96919
ΔH_f, kcal/mol:	5.35
Dipole, Da:	5.93
IP(EA), eV:	-9.81(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2-bromo-4-fluorophenyl)-4-cyclopropyl-1,2,4-triazole-3-sulfonamide

Drug info:

PubChemData

Smile

CC(C)N1C(=NN=C1S(=O)(=O)N)C2=CC=CC=C2I

DOS

IR

Vibrations