Geometry & MOs

Info

ID:	283923
PubChem CID:	104021166
Reduced:	SO2N4C13H16 (1)
Stoich.:	AB2C4D13E16 (1)
Weight, g/mol:	244.099397
ΔH_f, kcal/mol:	7.76
Dipole, Da:	5.29
IP(EA), eV:	-9.63(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-tert-butyl-5-cyclopropyl-1,2,4-triazole-3-sulfonamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CC2=NN=C(N2C3CC3)S(=O)(=O)N

DOS

IR

Vibrations