Geometry & MOs

Info

ID:	10090
PubChem CID:	97034
Reduced:	O2S2N3C13H17 (1)
Stoich.:	A2B2C3D13E17 (1)
Weight, g/mol:	311.076219
ΔH_f, kcal/mol:	-32.12
Dipole, Da:	7.98
IP(EA), eV:	-9.11(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]benzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)NC2=NN=C(S2)CC(C)C

DOS

IR

Vibrations