Geometry & MOs

Info

ID:	63685
PubChem CID:	26758970
Reduced:	NO4C21H27 (1)
Stoich.:	AB4C21D27 (1)
Weight, g/mol:	419.140259
ΔH_f, kcal/mol:	-155.29
Dipole, Da:	6.93
IP(EA), eV:	-8.95(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-[[(3R)-1,1-dioxothiolan-3-yl]-ethylamino]-1-oxopropan-2-yl] 3-methoxynaphthalene-2-carboxylate

Drug info:

PubChemData

Smile

C[C@@H](C(=O)N(C(C)C)C(C)C)OC(=O)C1=CC2=CC=CC=C2C=C1OC

DOS

IR

Vibrations