Geometry & MOs

Info

ID:	9315
PubChem CID:	87901
Reduced:	NO6C8H13 (1)
Stoich.:	AB6C8D13 (1)
Weight, g/mol:	219.074287
ΔH_f, kcal/mol:	-268.27
Dipole, Da:	3.81
IP(EA), eV:	-10.72(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-oxooxan-3-yl]acetamide

Drug info:

PubChemData

Smile

CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](OC1=O)CO)O)O

DOS

IR

Vibrations