Geometry & MOs

Info

ID:	147476
PubChem CID:	53787132
Reduced:	SO2C12H22 (1)
Stoich.:	AB2C12D22 (1)
Weight, g/mol:	492.001135
ΔH_f, kcal/mol:	-110.68
Dipole, Da:	2.79
IP(EA), eV:	-8.53(0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6'-hydroxy-3-oxospiro[2-benzofuran-1,9'-xanthene]-3'-yl) phosphono hydrogen phosphate

Drug info:

PubChemData

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CC(C)CSC[C@H]1[C@H](C1(C)C)C(=O)OC

DOS

IR

Vibrations