Geometry & MOs

Info

ID:	382279
PubChem CID:	134973335
Reduced:	NO10C11H19 (1)
Stoich.:	AB10C11D19 (1)
Weight, g/mol:	429.103727
ΔH_f, kcal/mol:	-452.5
Dipole, Da:	4.9
IP(EA), eV:	-10.51(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

potassium;2-[(1S,2R,3S,4R)-1-acetamido-2,3,4,5-tetrahydroxypentyl]-3-[(2-methylpropan-2-yl)oxycarbonyl]-5-oxo-2H-furan-4-olate

Drug info:

PubChemData

Smile

C1[C@H]([C@H](C(O[C@@]1(C(=O)O)O)[C@@H]([C@@H](CO)O)O)NC(=O)CO)O

DOS

IR

Vibrations