Geometry & MOs

Info

ID:	228275
PubChem CID:	87563790
Reduced:	PO15H21C31 (1)
Stoich.:	AB15C21D31 (1)
Weight, g/mol:	380.029719
ΔH_f, kcal/mol:	-443.75
Dipole, Da:	5.13
IP(EA), eV:	-9.2(-2.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-(3,7-dihydroxy-4-oxochromen-2-yl)-2-hydroxyphenyl]peroxy-methylphosphinic acid

Drug info:

PubChemData

Smile

CP(=O)(OOC1=C(C=CC(=C1)C2=C(C(=O)C3=C(O2)C=C(C=C3)O)O)O)OOC4=C(C=CC(=C4)C5=C(C(=O)C6=C(O5)C=C(C=C6)O)O)O

DOS

IR

Vibrations