Geometry & MOs

Info

ID:	36028
PubChem CID:	7980661
Reduced:	NO4H17C21 (1)
Stoich.:	AB4C17D21 (1)
Weight, g/mol:	363.147058
ΔH_f, kcal/mol:	-99.26
Dipole, Da:	3.12
IP(EA), eV:	-9.13(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-[(4-methoxyphenyl)methylamino]-1-oxopropan-2-yl] naphthalene-2-carboxylate

Drug info:

PubChemData

Smile

CC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)C2=CC3=CC=CC=C3C=C2

DOS

IR

Vibrations