Geometry & MOs

Info

ID:	10736
PubChem CID:	107522
Reduced:	PC6O9H13 (1)
Stoich.:	AB6C9D13 (1)
Weight, g/mol:	260.029719
ΔH_f, kcal/mol:	-453.69
Dipole, Da:	5.26
IP(EA), eV:	-10.52(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3S,4S,5R)-2,3,4,5-tetrahydroxy-6-oxohexyl] dihydrogen phosphate

Drug info:

PubChemData

Smile

C(C([C@@H]([C@@H]([C@H](C=O)O)O)O)O)OP(=O)(O)O

DOS

IR

Vibrations