Geometry & MOs

Info

ID:

440897

PubChem CID:

135232106

Reduced:

O5N8C81H162 (1)

Stoich.:

A5B8C81D162 (1)

Weight, g/mol:

1372.349822

ΔHf, kcal/mol:

-541.01

Dipole, Da:

2.29

IP(EA), eV:

 -8.79(0.9)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[[2-hydroxy-3-[4-[[2-hydroxy-3-[[2-oxo-2-(tetradecylamino)ethyl]-[2-oxo-2-(tridecylamino)ethyl]amino]propyl]-tetradecylamino]butyl-tetradecylamino]propyl]amino]-N-tetradecylacetamide

Drug info:

PubChemData

Smile

CCCCCCCCCCCCNC(=O)CCN(CCCCN(CCCN(CCC(=O)NCCCCCCCCCCCC)CCC(=O)NCCCCCCCCCCCC)CCC(=O)NCCCCCCCCCCC)CCC(=O)NCCCCCCCCCCCC

DOS

IR

Vibrations