Geometry & MOs

Info

ID:	141306
PubChem CID:	52857755
Reduced:	SF3O3N4C19H23 (1)
Stoich.:	AB3C3D4E19F23 (1)
Weight, g/mol:	301.114793
ΔH_f, kcal/mol:	-230.67
Dipole, Da:	6.19
IP(EA), eV:	-8.86(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-3-ethoxy-1-[(2-fluorophenyl)methylsulfonyl]piperidine

Drug info:

PubChemData

Smile

CCN1C=C(C=N1)NC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC(=CC=C3)C(F)(F)F

DOS

IR

Vibrations