Geometry & MOs

Info

ID:	310224
PubChem CID:	126576986
Reduced:	SC2F3H3O4 (1)
Stoich.:	AB2C3D3E4 (1)
Weight, g/mol:	456.244664
ΔH_f, kcal/mol:	-317.61
Dipole, Da:	3.37
IP(EA), eV:	-12.31(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

11,17-dihydroxy-6,9,10,13,16-pentamethyl-17-[2-(methylamino)-1,3-thiazol-4-yl]-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one

Drug info:

PubChemData

Smile

C(OC(F)(F)S(=O)(=O)O)F

DOS

IR

Vibrations