Geometry & MOs

Info

ID:

176838

PubChem CID:

76104522

Reduced:

SN2O5C18H22 (1)

Stoich.:

AB2C5D18E22 (1)

Weight, g/mol:

899.697921

ΔHf, kcal/mol:

-156.5

Dipole, Da:

4.06

IP(EA), eV:

 -9.15(0.02)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[5-[2,3-bis(3,7,11,15-tetramethylhexadecoxy)propoxy]-2-hydroxy-3-(hydroxymethyl)-6-oxo-4,7-dioxa-6lambda5-phosphatricyclo[3.2.1.01,6]octan-8-yl]acetamide

Drug info:

PubChemData

Smile

C1CC2(CC1CC2NC(=O)COC3=CC=CC=C3)S(=O)(=O)C4CNC4=O

DOS

IR

Vibrations