Geometry & MOs

Info

ID:	205764
PubChem CID:	80153948
Reduced:	FNO2C16H24 (1)
Stoich.:	ABC2D16E24 (1)
Weight, g/mol:	280.195092
ΔH_f, kcal/mol:	-131.73
Dipole, Da:	2.93
IP(EA), eV:	-8.69(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(4-ethoxypiperidin-1-yl)-5-fluoro-4-methylphenyl]ethanamine

Drug info:

PubChemData

Smile

CCC(C)N(CCOC)C1=C(C=C(C(=C1)C)F)C(=O)C

DOS

IR

Vibrations