Geometry & MOs

Info

ID:

376073

PubChem CID:

134222075

Reduced:

FO10C43H49 (1)

Stoich.:

AB10C43D49 (1)

Weight, g/mol:

1758.754016

ΔHf, kcal/mol:

-386.47

Dipole, Da:

4.15

IP(EA), eV:

 -9.21(0.12)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[5-[5-[5-aminopentoxy(phenylmethoxy)phosphanyl]oxy-2,3,4-tris(phenylmethoxy)pentoxy]-4-fluoro-2-(phenylmethoxymethyl)oxolan-3-yl] benzyl [5-[3-fluoro-4-phenylmethoxy-5-(phenylmethoxymethyl)oxolan-2-yl]oxy-2,3,4-tris(phenylmethoxy)pentyl] phosphite

Drug info:

PubChemData

Smile

CC(=O)CCC(=O)OC1C(OC(C1F)OCC(C(C(CO)OCC2=CC=CC=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4)COCC5=CC=CC=C5

DOS

IR

Vibrations