Geometry & MOs

Info

ID:	48970
PubChem CID:	11528537
Reduced:	OC6H12 (2)
Stoich.:	AB6C12 (2)
Weight, g/mol:	201.061278
ΔH_f, kcal/mol:	-138.88
Dipole, Da:	1.42
IP(EA), eV:	-9.82(1.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,4S,5S,6R)-4-amino-6-(trifluoromethyl)oxane-2,5-diol

Drug info:

PubChemData

Smile

CCCCCCC1(OCC(O1)CC)C

DOS

IR

Vibrations