Geometry & MOs

Info

ID:	121434
PubChem CID:	50767899
Reduced:	SN3O3C22H35 (1)
Stoich.:	AB3C3D22E35 (1)
Weight, g/mol:	407.224263
ΔH_f, kcal/mol:	-139.91
Dipole, Da:	4.81
IP(EA), eV:	-8.88(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(benzenesulfonyl)piperidin-4-yl]-N-[2-(2-methylpiperidin-1-yl)ethyl]acetamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)CC(=O)NCCC(C)N3CCCC3

DOS

IR

Vibrations