Geometry & MOs

Info

ID:

568

PubChem CID:

3006

Reduced:

FPO8C22H28 (1)

Stoich.:

ABC8D22E28 (1)

Weight, g/mol:

470.150583

ΔHf, kcal/mol:

-426.5

Dipole, Da:

10.38

IP(EA), eV:

 -9.73(-1.46)

Spin(Sz, S2):

 None, None

Charge, e:

 -2

Chem-info

IUPAC name:

[2-(9-fluoro-11,17-dihydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl)-2-oxoethyl] phosphate

Drug info:

PubChemData

Smile

CC1CC2C3CCC4=CC(=O)C=CC4(C3(C(CC2(C1(C(=O)COP(=O)([O-])[O-])O)C)O)F)C

DOS

IR

Vibrations