Geometry & MOs

Info

ID:	137482
PubChem CID:	52213541
Reduced:	ON2S2H16C17 (1)
Stoich.:	AB2C2D16E17 (1)
Weight, g/mol:	354.161329
ΔH_f, kcal/mol:	30.43
Dipole, Da:	4.63
IP(EA), eV:	-8.67(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(3S,5R)-3,5-dimethylpiperidin-1-yl]sulfonyl-N-ethyl-4-methoxybenzamide

Drug info:

PubChemData

Smile

CCNC(=O)CC1=C(N=C(S1)C2=CC=CC=C2)C3=CC=CS3

DOS

IR

Vibrations