Geometry & MOs

Info

ID:	28817
PubChem CID:	829808
Reduced:	FNO2C17H18 (1)
Stoich.:	ABC2D17E18 (1)
Weight, g/mol:	251.132157
ΔH_f, kcal/mol:	-96.63
Dipole, Da:	3.2
IP(EA), eV:	-8.81(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-fluorophenoxy)-1-[(3S)-3-methylpiperidin-1-yl]ethanone

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)NC(=O)[C@H](C)OC2=CC=CC=C2F)C

DOS

IR

Vibrations