Geometry & MOs

Info

ID:	13832
PubChem CID:	399268
Reduced:	SO7H10C15 (1)
Stoich.:	AB7C10D15 (1)
Weight, g/mol:	334.014724
ΔH_f, kcal/mol:	-200.9
Dipole, Da:	11.73
IP(EA), eV:	-9.02(-1.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-hydroxy-5-oxo-2-phenylchromen-7-yl) hydrogen sulfate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC(=C3C(=CC(=CC3=O)OS(=O)(=O)O)O2)O

DOS

IR

Vibrations