Geometry & MOs

Info

ID:	283971
PubChem CID:	104022815
Reduced:	SCl2O2N4C12H14 (1)
Stoich.:	AB2C2D4E12F14 (1)
Weight, g/mol:	286.055818
ΔH_f, kcal/mol:	-34.72
Dipole, Da:	2.84
IP(EA), eV:	-10.13(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-methylpropyl)-5-thiophen-3-yl-1,2,4-triazole-3-sulfonamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations