Geometry & MOs

Info

ID:	283944
PubChem CID:	104021977
Reduced:	SO2N6C12H14 (1)
Stoich.:	AB2C6D12E14 (1)
Weight, g/mol:	276.125612
ΔH_f, kcal/mol:	25.61
Dipole, Da:	6.55
IP(EA), eV:	-9.13(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3-ethoxypropyl)-4-propyl-1,2,4-triazole-3-sulfonamide

Drug info:

PubChemData

Smile

CCCN1C(=NN=C1S(=O)(=O)N)C2=NNC3=CC=CC=C32

DOS

IR

Vibrations