Geometry & MOs

Info

ID:	404764
PubChem CID:	135070643
Reduced:	O3C5H6 (2)
Stoich.:	A3B5C6 (2)
Weight, g/mol:	311.101645
ΔH_f, kcal/mol:	-235.59
Dipole, Da:	3.91
IP(EA), eV:	-11.04(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,4R,5R)-5-acetamido-6-(1-fluoro-2,3-dihydroxypropyl)-2,4-dihydroxyoxane-2-carboxylic acid

Drug info:

PubChemData

Smile

COC(=O)C1(C[C@@H]2C(C1)C(=O)O2)C(=O)OC

DOS

IR

Vibrations