Geometry & MOs

Info

ID:

309270

PubChem CID:

126541444

Reduced:

OS3C24H32 (1)

Stoich.:

AB3C24D32 (1)

Weight, g/mol:

586.320056

ΔHf, kcal/mol:

-37.7

Dipole, Da:

0.35

IP(EA), eV:

 -8.49(-0.6)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

6-[2-[2-[3-[2-[2-[(2R,3S,5R)-4,5-dihydroxy-6-(hydroxymethyl)-3-methyloxan-2-yl]oxyethoxy]ethoxy]-2-methylpropoxy]ethoxy]ethoxy]-2-(hydroxymethyl)-5-methyloxane-3,4-diol

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1C(=O)SCC2=CC=CC=C2CSCCC(C)(C)CCS

DOS

IR

Vibrations