Geometry & MOs

Info

ID:	57330
PubChem CID:	22395672
Reduced:	O9C15H20 (1)
Stoich.:	A9B15C20 (1)
Weight, g/mol:	309.985485
ΔH_f, kcal/mol:	-386.04
Dipole, Da:	4.74
IP(EA), eV:	-10.26(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

phosphono (3,4,5-trihydroxyoxan-2-yl) hydrogen phosphate

Drug info:

PubChemData

Smile

CC1=CC(C(C(C1)(C(=O)OC2C=C(CC(C2O)O)C(=O)O)O)O)O

DOS

IR

Vibrations