Geometry & MOs

Info

ID:	338755
PubChem CID:	127259766
Reduced:	NO3C21H31 (1)
Stoich.:	AB3C21D31 (1)
Weight, g/mol:	381.207072
ΔH_f, kcal/mol:	-149.7
Dipole, Da:	2.1
IP(EA), eV:	-8.57(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2-hydroxycyclohexyl)-(1-methylpiperidin-4-yl)methyl] 2-phenylacetate;hydrochloride

Drug info:

PubChemData

Smile

CN1CCC(CC1)C(C2(CCCCC2)O)OC(=O)CC3=CC=CC=C3

DOS

IR

Vibrations