Geometry & MOs

Info

ID:	217789
PubChem CID:	85088392
Reduced:	ClMgH8C11 (2)
Stoich.:	ABC8D11 (2)
Weight, g/mol:	399.972552
ΔH_f, kcal/mol:	-68.79
Dipole, Da:	3.2
IP(EA), eV:	-8.1(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-ethenyl-4-hydroxy-3,5-diphosphonooxycyclopentyl) dihydrogen phosphate

Drug info:

PubChemData

Smile

[CH2-]C1=C(C2=CC=CC=C2C=C1)C3=C(C=CC4=CC=CC=C43)[CH2-].[Mg+2].[Mg+2].[Cl-].[Cl-]

DOS

IR

Vibrations