Geometry & MOs

Info

ID:	142141
PubChem CID:	52988160
Reduced:	ClO2N4C6H11 (1)
Stoich.:	AB2C4D6E11 (1)
Weight, g/mol:	392.188212
ΔH_f, kcal/mol:	-83.84
Dipole, Da:	5.54
IP(EA), eV:	-9.65(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3,3a,4,5,6,7,7a-octahydro-1H-indazol-5-yl)-3-(cyclopentylsulfamoyl)benzamide

Drug info:

PubChemData

Smile

CC(C1=NNC(=N1)CC(=O)O)N.Cl

DOS

IR

Vibrations