Geometry & MOs

Info

ID:	121438
PubChem CID:	50768002
Reduced:	SN3O3C20H31 (1)
Stoich.:	AB3C3D20E31 (1)
Weight, g/mol:	416.176979
ΔH_f, kcal/mol:	-125.49
Dipole, Da:	6.67
IP(EA), eV:	-8.98(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(benzenesulfonyl)piperidin-4-yl]-N-[(2-ethoxyphenyl)methyl]acetamide

Drug info:

PubChemData

Smile

C1CCN(CC1)CCNC(=O)CC2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

DOS

IR

Vibrations