Geometry & MOs

Info

ID:	337279
PubChem CID:	127256961
Reduced:	NO4C15H21 (1)
Stoich.:	AB4C15D21 (1)
Weight, g/mol:	263.152144
ΔH_f, kcal/mol:	-160.57
Dipole, Da:	4.8
IP(EA), eV:	-8.93(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-hydroxyphenyl)propan-2-yl piperidine-3-carboxylate

Drug info:

PubChemData

Smile

COC1=CC(=CC(=C1)C[C@@H]2[C@H](CCCN2)C(=O)O)OC

DOS

IR

Vibrations