Geometry & MOs

Info

ID:	382034
PubChem CID:	134972937
Reduced:	O2C13H20 (1)
Stoich.:	A2B13C20 (1)
Weight, g/mol:	327.096559
ΔH_f, kcal/mol:	-77.5
Dipole, Da:	1.24
IP(EA), eV:	-10.24(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,5R)-5-acetamido-3-fluoro-2,4-dihydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid

Drug info:

PubChemData

Smile

CCCCCC/C=C/C(=O)CC(=O)C=C

DOS

IR

Vibrations