Geometry & MOs

Info

ID:	18461
PubChem CID:	541287
Reduced:	NO5C21H25 (1)
Stoich.:	AB5C21D25 (1)
Weight, g/mol:	371.173273
ΔH_f, kcal/mol:	-164.75
Dipole, Da:	5.08
IP(EA), eV:	-8.46(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4,4-bis(3-hydroxy-4-methoxyphenyl)piperidin-1-yl]ethanone

Drug info:

PubChemData

Smile

CC(=O)N1CCC(CC1)(C2=CC(=C(C=C2)OC)O)C3=CC(=C(C=C3)OC)O

DOS

IR

Vibrations