Geometry & MOs

Info

ID:

147545

PubChem CID:

53787201

Reduced:

SN2F3O8H17C18 (1)

Stoich.:

AB2C3D8E17F18 (1)

Weight, g/mol:

1026.8099

ΔHf, kcal/mol:

-453.84

Dipole, Da:

5.09

IP(EA), eV:

 -9.78(-1.69)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[3-hydroxy-2-[2-(1-hydroxy-3-octadeca-9,12-dienoyloxypropan-2-yl)oxy-3-octadeca-9,12,15-trienoyloxypropoxy]propyl] octadec-9-enoate

Drug info:

PubChemData

Smile

CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)COC(=O)C3=CC=CC=C3)OS(=O)(=O)C(F)(F)F

DOS

IR

Vibrations