Geometry & MOs

Info

ID:	283954
PubChem CID:	104022460
Reduced:	SF2O2N4H8C9 (1)
Stoich.:	AB2C2D4E8F9 (1)
Weight, g/mol:	286.055818
ΔH_f, kcal/mol:	-89.35
Dipole, Da:	3.76
IP(EA), eV:	-10.22(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-5-(3-thiophen-2-ylpropyl)-1,2,4-triazole-3-sulfonamide

Drug info:

PubChemData

Smile

CN1C(=NN=C1S(=O)(=O)N)C2=CC(=C(C=C2)F)F

DOS

IR

Vibrations