Geometry & MOs

Info

ID:	339960
PubChem CID:	127261969
Reduced:	O3N4C19H30 (1)
Stoich.:	A3B4C19D30 (1)
Weight, g/mol:	343.129708
ΔH_f, kcal/mol:	-125.25
Dipole, Da:	5.14
IP(EA), eV:	-9.31(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1R)-1-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-[(2S)-2-aminopropanoyl]amino]ethyl]phosphonic acid

Drug info:

PubChemData

Smile

C[C@@H](C(=O)N([C@@H](CC1=CC=CC=C1)C(=O)N)C(CCCCN)C(=O)C)N

DOS

IR

Vibrations