Geometry & MOs

Info

ID:

327751

PubChem CID:

126690969

Reduced:

OF3C8H11 (1)

Stoich.:

AB3C8D11 (1)

Weight, g/mol:

746.247677

ΔHf, kcal/mol:

-214.87

Dipole, Da:

3.38

IP(EA), eV:

-11.07(1.44)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

5-O-[2-[[5-(ethenoxymethyl)-2-bicyclo[2.2.1]heptanyl]methyl]-1,1,1,3,3,3-hexafluoropropan-2-yl] 1-O-[5-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl] 2-methylidenepentanedioate

Drug info:

PubChemData

Smile

C1CC2C[C@H]1CC2(C(F)(F)F)O

DOS

IR

Vibrations