Geometry & MOs

Info

ID:	223515
PubChem CID:	85335155
Reduced:	NSF3O4C18H18 (1)
Stoich.:	ABC3D4E18F18 (1)
Weight, g/mol:	402.197714
ΔH_f, kcal/mol:	-265.4
Dipole, Da:	1.77
IP(EA), eV:	-8.76(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(2,6-dimethylpiperidin-1-yl)-2-hydroxypropyl]-4-phenylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC1=C(N=C(S1)CC(F)(F)F)OCC2=CC=CC=C2C(=COC)C(=O)OC

DOS

IR

Vibrations