Geometry & MOs

Info

ID:	339939
PubChem CID:	127261948
Reduced:	O3N4C13H26 (1)
Stoich.:	A3B4C13D26 (1)
Weight, g/mol:	328.247441
ΔH_f, kcal/mol:	-161.39
Dipole, Da:	3.6
IP(EA), eV:	-9.4(0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[[(2S)-2-acetamido-4-methylpentanoyl]-ethylamino]-6-aminohexanamide

Drug info:

PubChemData

Smile

CCN([C@@H](CCCCN)C(=O)N)C(=O)[C@H](C)NC(=O)C

DOS

IR

Vibrations