Geometry & MOs

Info

ID:	339520
PubChem CID:	127261510
Reduced:	N2O2C8H11 (2)
Stoich.:	A2B2C8D11 (2)
Weight, g/mol:	479.205636
ΔH_f, kcal/mol:	-170.71
Dipole, Da:	3.94
IP(EA), eV:	-9.55(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[3-(4-aminobutoxy)naphthalene-2-carbonyl]-[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]acetic acid

Drug info:

PubChemData

Smile

CC(=O)N[C@@H](CC(=O)N)C(=O)N(CCC1=CC=CC=C1)CC(=O)N

DOS

IR

Vibrations