Geometry & MOs

Info

ID:	410427
PubChem CID:	135083223
Reduced:	O3C15H22 (1)
Stoich.:	A3B15C22 (1)
Weight, g/mol:	284.100836
ΔH_f, kcal/mol:	-143.16
Dipole, Da:	3.1
IP(EA), eV:	-9.4(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-[(E)-pyridin-2-ylmethylideneamino]oxyoxane-3,4,5-triol

Drug info:

PubChemData

Smile

CC1(O[C@@H](C[C@@H](O1)CC2=CC=CC=C2)CCO)C

DOS

IR

Vibrations