Geometry & MOs

Info

ID:	162485
PubChem CID:	57394828
Reduced:	O2N4C23H26 (1)
Stoich.:	A2B4C23D26 (1)
Weight, g/mol:	382.236876
ΔH_f, kcal/mol:	-28.42
Dipole, Da:	7.88
IP(EA), eV:	-8.58(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2,5-diamino-N-[1-(benzylamino)-1-oxo-4-phenylbutan-2-yl]pentanamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations