Geometry & MOs

Info

ID:	402585
PubChem CID:	135056480
Reduced:	NO4C8H17 (1)
Stoich.:	AB4C8D17 (1)
Weight, g/mol:	194.079038
ΔH_f, kcal/mol:	-220.32
Dipole, Da:	2.25
IP(EA), eV:	-10.47(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,4R)-3,4,5,6,7-pentahydroxyheptan-2-one

Drug info:

PubChemData

Smile

CCOC(=O)C[C@@H](C)[NH3+].CC(=O)[O-]

DOS

IR

Vibrations