Geometry & MOs

Info

ID:	166138
PubChem CID:	74642430
Reduced:	NO3C25H25 (1)
Stoich.:	AB3C25D25 (1)
Weight, g/mol:	373.194974
ΔH_f, kcal/mol:	-63.68
Dipole, Da:	5.37
IP(EA), eV:	-8.79(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

2,4-dimethyl-N-(1-phenyl-2-piperidin-1-ium-1-ylethyl)benzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=O)NC(CCC2=CC=CC=C2)C3=CC4=C(C=C3)OCCO4

DOS

IR

Vibrations