Geometry & MOs

Info

ID:	34356
PubChem CID:	7890909
Reduced:	NS2O5C18H21 (1)
Stoich.:	AB2C5D18E21 (1)
Weight, g/mol:	363.147058
ΔH_f, kcal/mol:	-191.61
Dipole, Da:	1.56
IP(EA), eV:	-8.86(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-oxo-2-[[(2R)-2-phenylpropyl]amino]ethyl] 1-hydroxynaphthalene-2-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(SC(=C1)C(C)C)NC(=O)COC(=O)CC2=CC=CS2

DOS

IR

Vibrations