Geometry & MOs

Info

ID:	60536
PubChem CID:	26697152
Reduced:	SN2O3C22H28 (1)
Stoich.:	AB2C3D22E28 (1)
Weight, g/mol:	386.166414
ΔH_f, kcal/mol:	-114.26
Dipole, Da:	5.83
IP(EA), eV:	-8.6(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-ethylphenyl)-4-(4-methylpiperidin-1-yl)sulfonylbenzamide

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)C)C

DOS

IR

Vibrations