Geometry & MOs

Info

ID:	402619
PubChem CID:	135056605
Reduced:	O3C12H14 (1)
Stoich.:	A3B12C14 (1)
Weight, g/mol:	277.995832
ΔH_f, kcal/mol:	-102.56
Dipole, Da:	2.32
IP(EA), eV:	-9.65(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(5R)-6-chloro-3,4,5-trihydroxy-2-oxohexyl] dihydrogen phosphate

Drug info:

PubChemData

Smile

COC(=O)C1=CC=C(C=C1)/C=C/CCO

DOS

IR

Vibrations