Geometry & MOs

Info

ID:	137943
PubChem CID:	52289087
Reduced:	FNO3C21H22 (1)
Stoich.:	ABC3D21E22 (1)
Weight, g/mol:	407.180467
ΔH_f, kcal/mol:	-113.54
Dipole, Da:	2.2
IP(EA), eV:	-9.05(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

2-fluoro-N-[(2R)-2-(2-methoxyphenyl)-2-piperidin-1-ium-1-ylethyl]-5-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

C[C@H](C1=CC2=CC=CC=C2O1)N(C)C(=O)C(C)(C)OC3=CC=C(C=C3)F

DOS

IR

Vibrations