Geometry & MOs

Info

ID:	216428
PubChem CID:	85086223
Reduced:	ClO3N5C9H10 (1)
Stoich.:	AB3C5D9E10 (1)
Weight, g/mol:	268.082423
ΔH_f, kcal/mol:	-22.59
Dipole, Da:	8.73
IP(EA), eV:	-9.67(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-5-oxo-5-(1-phosphonopropylamino)pentanoic acid

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)[N+](=O)[O-])NC2NC(NC(=O)N2)Cl

DOS

IR

Vibrations