Geometry & MOs

Info

ID:

47625

PubChem CID:

10534541

Reduced:

N2O8C42H63 (2)

Stoich.:

A2B8C42D63 (2)

Weight, g/mol:

1450.63576

ΔHf, kcal/mol:

-778.19

Dipole, Da:

4.77

IP(EA), eV:

 -8.04(-1.84)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

bis[(2R)-3-[2-bromoethoxy(2-cyanoethoxy)phosphoryl]oxy-2-(8-methoxyoctanoyloxy)propyl] dotriacontanedioate

Drug info:

PubChemData

Smile

CCCCCCOC(=O)CC1=C(C2=CC3=NC(=CC4=NC(=CC5=C(C(=C(N5)C=C1N2)CC(=O)OCCCCCC)CC(=O)OCCCCCC)C(=C4CC(=O)OCCCCCC)CC(=O)OCCCCCC)C(=C3CC(=O)OCCCCCC)CC(=O)OCCCCCC)CC(=O)OCCCCCC

DOS

IR

Vibrations