Geometry & MOs

Info

ID:	121401
PubChem CID:	50766777
Reduced:	SN2O4C15H24 (1)
Stoich.:	AB2C4D15E24 (1)
Weight, g/mol:	497.234828
ΔH_f, kcal/mol:	-170.04
Dipole, Da:	4.26
IP(EA), eV:	-8.77(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-piperidin-1-ylpiperidin-1-yl)-5-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)benzoic acid

Drug info:

PubChemData

Smile

CCCCN(CC)C1=C(C=C(C=C1)NS(=O)(=O)CC)C(=O)O

DOS

IR

Vibrations