Geometry & MOs

Info

ID:

600

PubChem CID:

3057

Reduced:

F2O5C27H36 (1)

Stoich.:

A2B5C27D36 (1)

Weight, g/mol:

478.253081

ΔHf, kcal/mol:

-336.27

Dipole, Da:

9.54

IP(EA), eV:

 -9.92(-0.6)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[2-(6,9-difluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-7,8,11,12,14,15,16,17-octahydro-6H-cyclopenta[a]phenanthren-17-yl)-2-oxoethyl] 2,2-dimethylpropanoate

Drug info:

PubChemData

Smile

CC1CC2C3CC(C4=CC(=O)C=CC4(C3(C(CC2(C1C(=O)COC(=O)C(C)(C)C)C)O)F)C)F

DOS

IR

Vibrations