Geometry & MOs

Info

ID:	446389
PubChem CID:	135274601
Reduced:	F4O11C24H45 (2)
Stoich.:	A4B11C24D45 (2)
Weight, g/mol:	480.134388
ΔH_f, kcal/mol:	-768.82
Dipole, Da:	11.23
IP(EA), eV:	-9.25(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2,3-bis(2,3-dihydroxypropylsulfanyl)-4-(2-hydroxybutylsulfanyl)butyl]sulfanylpropane-1,2-diol

Drug info:

PubChemData

Smile

CCC(COCCOF)(COCCOF)COCC(COCC(CC)(COCCOF)COCCOF)OCCOC(COCC(CC)(COCCOF)COCCOF)COCC(CC)(COCCOF)COCCOF

DOS

IR

Vibrations