Geometry & MOs

Info

ID:	197193
PubChem CID:	78935790
Reduced:	FNO3C13H18 (1)
Stoich.:	ABC3D13E18 (1)
Weight, g/mol:	250.184527
ΔH_f, kcal/mol:	-168.55
Dipole, Da:	1.77
IP(EA), eV:	-9.23(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-[2-(2-ethylpiperidin-1-yl)-5-fluorophenyl]ethanamine

Drug info:

PubChemData

Smile

CCOC(=O)C(C)OC1=C(C=CC(=C1)F)[C@H](C)N

DOS

IR

Vibrations