Geometry & MOs

Info

ID:	234714
PubChem CID:	92303364
Reduced:	FNO8C14H20 (1)
Stoich.:	ABC8D14E20 (1)
Weight, g/mol:	403.089029
ΔH_f, kcal/mol:	-425.45
Dipole, Da:	1.85
IP(EA), eV:	-10.3(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R,3R,4R,5S,6S)-3,4-diacetyloxy-6-fluoro-5-[(2,2,2-trifluoroacetyl)amino]oxan-2-yl]methyl acetate

Drug info:

PubChemData

Smile

CC(=O)N[C@H]1[C@H]([C@@H]([C@@H](O[C@@H]1OC(=O)C)COC(=O)C)F)OC(=O)C

DOS

IR

Vibrations