Geometry & MOs

Info

ID:	260601
PubChem CID:	103196846
Reduced:	NOC7H9 (2)
Stoich.:	ABC7D9 (2)
Weight, g/mol:	292.142307
ΔH_f, kcal/mol:	-63.18
Dipole, Da:	4.04
IP(EA), eV:	-8.87(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(3,4-dihydroxyphenyl)-2-oxoethyl]-N-methylpiperidine-3-carboxamide

Drug info:

PubChemData

Smile

C1CC2C(CNC2=O)N(C1)C3=CC=C(C=C3)CO

DOS

IR

Vibrations