Geometry & MOs

Info

ID:

375740

PubChem CID:

134221730

Reduced:

PO19C88H99 (1)

Stoich.:

AB19C88D99 (1)

Weight, g/mol:

866.402998

ΔHf, kcal/mol:

-661.29

Dipole, Da:

7.12

IP(EA), eV:

 -8.9(-0.12)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[(3R)-5-[5-(naphthalen-2-ylmethoxy)-2,3,4-tris(phenylmethoxy)pentoxy]-2-(phenylmethoxymethyl)oxolan-3-yl] 4-oxopentanoate

Drug info:

PubChemData

Smile

CC(=O)CCC(=O)O[C@@H]1CC(OC1COCC2=CC=CC=C2)OCC(C(C(COP(OCC3=CC=CC=C3)O[C@@H]4CC(OC4COCC5=CC=CC=C5)OCC(C(C(CO)OCC6=CC=CC=C6)OCC7=CC=CC=C7)OCC8=CC=CC=C8)OCC9=CC=CC=C9)OCC1=CC=CC=C1)OCC1=CC=CC=C1

DOS

IR

Vibrations