Geometry & MOs

Info

ID:	187997
PubChem CID:	77652236
Reduced:	S2O11C20H24 (1)
Stoich.:	A2B11C20D24 (1)
Weight, g/mol:	346.152872
ΔH_f, kcal/mol:	-465.51
Dipole, Da:	6.23
IP(EA), eV:	-9.69(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(3-aminonaphthalene-2-carbonyl)amino]-3-(2-methoxyethoxy)propanoate

Drug info:

PubChemData

Smile

CC(=O)OCC1C(C(C(C(O1)C2=CC=CC=C2S(=O)(=S)O)OC(=O)C)OC(=O)C)OC(=O)C

DOS

IR

Vibrations