Geometry & MOs

Info

ID:	382781
PubChem CID:	134974122
Reduced:	O2C19H22 (1)
Stoich.:	A2B19C22 (1)
Weight, g/mol:	363.204573
ΔH_f, kcal/mol:	-63.89
Dipole, Da:	1.71
IP(EA), eV:	-9.34(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (2R,3R)-2-(2-ethoxy-2-oxoethyl)-1-[(1S)-2-hydroxy-1-phenylethyl]piperidine-3-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)[C@H](CC1=CC=CC=C1)[C@@H](C)C2=CC=CC=C2

DOS

IR

Vibrations