Geometry & MOs

Info

ID:	222449
PubChem CID:	85300754
Reduced:	N2O2C8H9 (2)
Stoich.:	A2B2C8D9 (2)
Weight, g/mol:	330.157957
ΔH_f, kcal/mol:	-87.62
Dipole, Da:	1.82
IP(EA), eV:	-8.68(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3,4,5-trihydroxy-6-methylpiperidin-2-yl)methyl]naphthalene-2-carboxamide

Drug info:

PubChemData

Smile

CCOC(=O)C12C3C(C(=O)N(C3=O)C)NN1C4=CC=CC=C4N2C

DOS

IR

Vibrations