Geometry & MOs

Info

ID:	2792
PubChem CID:	8565
Reduced:	NO9C11H19 (1)
Stoich.:	AB9C11D19 (1)
Weight, g/mol:	309.105981
ΔH_f, kcal/mol:	-416.29
Dipole, Da:	7.43
IP(EA), eV:	-10.25(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,4S,5R,6R)-5-acetamido-2,4-dihydroxy-6-(1,2,3-trihydroxypropyl)oxane-2-carboxylic acid

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations