Geometry & MOs

Info

ID:	336667
PubChem CID:	127255674
Reduced:	ClFNOC7H9 (1)
Stoich.:	ABCDE7F9 (1)
Weight, g/mol:	287.03684
ΔH_f, kcal/mol:	-102.86
Dipole, Da:	4.7
IP(EA), eV:	-9.56(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3S,4R,5S,6S)-2-(2-aminoethoxy)-6-methyloxane-3,4,5-triol;hydrobromide

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1CN)O)F.Cl

DOS

IR

Vibrations