Geometry & MOs

Info

ID:	289074
PubChem CID:	104334031
Reduced:	SO2N3C9H17 (1)
Stoich.:	AB2C3D9E17 (1)
Weight, g/mol:	326.087118
ΔH_f, kcal/mol:	-61.48
Dipole, Da:	7.89
IP(EA), eV:	-9.18(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-methylpiperidin-4-yl)methyl]-2,1,3-benzothiadiazole-4-sulfonamide

Drug info:

PubChemData

Smile

CC1(CCNCC1)CNS(=O)(=O)CC#N

DOS

IR

Vibrations