Geometry & MOs

Info

ID:

375755

PubChem CID:

134221745

Reduced:

PF2O19C88H97 (1)

Stoich.:

AB2C19D88E97 (1)

Weight, g/mol:

884.393576

ΔHf, kcal/mol:

-730.24

Dipole, Da:

12.43

IP(EA), eV:

 -9.15(-0.32)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[4-fluoro-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)OC1C(OC(C1F)OCC(C(C(COP(OCC2=CC=CC=C2)OC3C(OC(C3F)OCC(C(C(CO)OCC4=CC=CC=C4)OCC5=CC=CC=C5)OCC6=CC=CC=C6)COCC7=CC=CC=C7)OCC8=CC=CC=C8)OCC9=CC=CC=C9)OCC1=CC=CC=C1)COCC1=CC=CC=C1

DOS

IR

Vibrations