Geometry & MOs

Info

ID:	28769
PubChem CID:	829493
Reduced:	FNO2C15H22 (1)
Stoich.:	ABC2D15E22 (1)
Weight, g/mol:	267.163457
ΔH_f, kcal/mol:	-128.26
Dipole, Da:	1.19
IP(EA), eV:	-8.82(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-[(2-fluorophenyl)methoxy]-3-piperidin-1-ylpropan-2-ol

Drug info:

PubChemData

Smile

C1CCN(CC1)C[C@H](COCC2=CC=CC=C2F)O

DOS

IR

Vibrations