Geometry & MOs

Info

ID:	16879
PubChem CID:	478262
Reduced:	ON2C12H14 (2)
Stoich.:	AB2C12D14 (2)
Weight, g/mol:	404.221226
ΔH_f, kcal/mol:	-36.75
Dipole, Da:	1.44
IP(EA), eV:	-8.7(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-5-amino-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]-N-naphthalen-2-ylpentanamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C[C@@H](C(=O)N[C@@H](CCCN)C(=O)NC2=CC3=CC=CC=C3C=C2)N

DOS

IR

Vibrations