Geometry & MOs

Info

ID:	134396
PubChem CID:	51690254
Reduced:	FSN2O3C26H27 (1)
Stoich.:	ABC2D3E26F27 (1)
Weight, g/mol:	466.172642
ΔH_f, kcal/mol:	-107.29
Dipole, Da:	5.62
IP(EA), eV:	-9.48(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-N-[(1R)-1,2-diphenylethyl]-1-(4-fluorophenyl)sulfonylpiperidine-3-carboxamide

Drug info:

PubChemData

Smile

C1C[C@H](CN(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)N[C@H](CC3=CC=CC=C3)C4=CC=CC=C4

DOS

IR

Vibrations