Geometry & MOs

Info

ID:	272849
PubChem CID:	103762167
Reduced:	N2S2O3C13H20 (1)
Stoich.:	A2B2C3D13E20 (1)
Weight, g/mol:	267.127072
ΔH_f, kcal/mol:	-97.32
Dipole, Da:	6.06
IP(EA), eV:	-9.55(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-fluoro-4-methoxyphenyl)-(4-hydroxy-4-methylpiperidin-1-yl)methanone

Drug info:

PubChemData

Smile

CCCC1(CC1)CNC(=O)CC2=CC=C(S2)S(=O)(=O)N

DOS

IR

Vibrations