Geometry & MOs

Info

ID:	304063
PubChem CID:	124491953
Reduced:	FNO2C16H22 (1)
Stoich.:	ABC2D16E22 (1)
Weight, g/mol:	248.188863
ΔH_f, kcal/mol:	-135.97
Dipole, Da:	3.1
IP(EA), eV:	-8.94(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3S)-2-(aminomethyl)-3-phenyl-3-piperidin-1-ylpropan-1-ol

Drug info:

PubChemData

Smile

CCOC(=O)C[C@H](C1=CC=C(C=C1)F)N2CCCCC2

DOS

IR

Vibrations