Geometry & MOs

Info

ID:

85309

PubChem CID:

49873689

Reduced:

FO10C13H23 (1)

Stoich.:

AB10C13D23 (1)

Weight, g/mol:

344.111875

ΔHf, kcal/mol:

-505.64

Dipole, Da:

2.59

IP(EA), eV:

 -10.25(0.32)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(2R,3R,4S,5S,6R)-2-[(2R,3R,4S,5S,6S)-6-(fluoromethyl)-3,4,5-trihydroxyoxan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

Drug info:

PubChemData

Smile

C[C@]1([C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)F

DOS

IR

Vibrations