Geometry & MOs

Info

ID:	407991
PubChem CID:	135080746
Reduced:	NO6C9H17 (1)
Stoich.:	AB6C9D17 (1)
Weight, g/mol:	276.006876
ΔH_f, kcal/mol:	-281.54
Dipole, Da:	6.47
IP(EA), eV:	-9.9(0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(5S)-3,4,5,6-tetrahydroxy-2-oxohexyl]sulfanylphosphonic acid

Drug info:

PubChemData

Smile

CC(=O)NC1[C@@H](OC([C@H](C1O)OC)CO)O

DOS

IR

Vibrations