Geometry & MOs

Info

ID:	56948
PubChem CID:	22395023
Reduced:	BaPH3O3 (1)
Stoich.:	ABC3D3 (1)
Weight, g/mol:	319.082743
ΔH_f, kcal/mol:	-312.24
Dipole, Da:	5.06
IP(EA), eV:	-7.04(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

sodium;4-methoxy-2-methyl-1,4-dioxo-1-pentoxybutane-2-sulfonic acid

Drug info:

PubChemData

Smile

OP(O)O.[Ba+2]

DOS

IR

Vibrations