Geometry & MOs

Info

ID:	283966
PubChem CID:	104022603
Reduced:	SO2N5C10H13 (1)
Stoich.:	AB2C5D10E13 (1)
Weight, g/mol:	301.157246
ΔH_f, kcal/mol:	-3.1
Dipole, Da:	6.44
IP(EA), eV:	-10.2(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-methylpropyl)-5-(2-pyrrolidin-1-ylethyl)-1,2,4-triazole-3-sulfonamide

Drug info:

PubChemData

Smile

CN1C(=NN=C1S(=O)(=O)N)CCC2=CC=CC=N2

DOS

IR

Vibrations