Geometry & MOs

Info

ID:	195312
PubChem CID:	78672337
Reduced:	NSO5C15H21 (1)
Stoich.:	ABC5D15E21 (1)
Weight, g/mol:	380.233802
ΔH_f, kcal/mol:	-197.33
Dipole, Da:	2.01
IP(EA), eV:	-10.1(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

2-benzamido-N-[3-(2-methylpiperidin-1-ium-1-yl)propyl]benzamide

Drug info:

PubChemData

Smile

CCC(C)C(C(=O)OC)NS(=O)(=O)C1=CC=C(C=C1)C(=O)C

DOS

IR

Vibrations