Geometry & MOs

Info

ID:	182999
PubChem CID:	76968563
Reduced:	OC11H18 (2)
Stoich.:	AB11C18 (2)
Weight, g/mol:	419.933833
ΔH_f, kcal/mol:	-134.17
Dipole, Da:	5.88
IP(EA), eV:	-9.7(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R,3S,4S,5S,6S)-4,6-dihydroxy-3,5-disulfooxyoxan-2-yl]methyl hydrogen sulfate

Drug info:

PubChemData

Smile

C[C@@H]1[C@@H]2CC[C@@H](C2)[C@@]1(C)C(=O)C.C[C@H]1[C@H]2CC[C@H](C2)[C@]1(C)C(=O)C

DOS

IR

Vibrations