Geometry & MOs

Info

ID:	176772
PubChem CID:	76097161
Reduced:	OCl2N5C16H17 (1)
Stoich.:	AB2C5D16E17 (1)
Weight, g/mol:	214.02424
ΔH_f, kcal/mol:	18.96
Dipole, Da:	3.35
IP(EA), eV:	-9.01(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1,2,5-trihydroxy-4-oxopentan-3-yl) dihydrogen phosphite

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CNNC2NC(NC(=O)N2)C3=CC(=C(C=C3)Cl)Cl

DOS

IR

Vibrations