Geometry & MOs

Info

ID:	311655
PubChem CID:	126596839
Reduced:	PN4O10C18H23 (1)
Stoich.:	AB4C10D18E23 (1)
Weight, g/mol:	454.125351
ΔH_f, kcal/mol:	-337.66
Dipole, Da:	4.12
IP(EA), eV:	-9.46(-1.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[[[(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)amino]oxy-phenoxyphosphoryl]-propan-2-ylamino]propanoic acid

Drug info:

PubChemData

Smile

C[C@@H](C(=O)OC(C)C)NP(=O)(O)OOC1=CC=CC=C1ON=C2C(=O)N(C(=O)N(C2=O)C)C

DOS

IR

Vibrations