Geometry & MOs

Info

ID:

312526

PubChem CID:

126606250

Reduced:

OC12H18 (1)

Stoich.:

AB12C18 (1)

Weight, g/mol:

1074.267502

ΔHf, kcal/mol:

-53.71

Dipole, Da:

1.54

IP(EA), eV:

-8.2(0.58)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

3-[1-[1-[bis(2-ethylhexoxy)phosphinothioylsulfanyl]propan-2-yloxy-[1-[2-ethylhexoxy(sulfanyl)phosphanyl]sulfanylpropan-2-yloxy]phosphinothioyl]sulfanylpropan-2-yloxy-propan-2-yloxyphosphinothioyl]sulfanylpropanoic acid

Drug info:

PubChemData

Smile

CCC1=C(C=C(C(=C1)C)C)OCC

DOS

IR

Vibrations