Geometry & MOs

Info

ID:	339901
PubChem CID:	127261910
Reduced:	NSO3C17H25 (1)
Stoich.:	ABC3D17E25 (1)
Weight, g/mol:	432.252526
ΔH_f, kcal/mol:	-145.52
Dipole, Da:	5.94
IP(EA), eV:	-9.01(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-6-amino-2-(N-[(2R)-2-amino-3-naphthalen-1-ylpropanoyl]-4-methylanilino)hexanamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations