Geometry & MOs

Info

ID:	25497
PubChem CID:	625876
Reduced:	O2F3H9C16 (1)
Stoich.:	A2B3C9D16 (1)
Weight, g/mol:	290.22458
ΔH_f, kcal/mol:	-189.9
Dipole, Da:	5.4
IP(EA), eV:	-9.7(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

10,13-dimethyl-2,3,4,5,6,7,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,17-diol

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C3=C(C=C(C=C3)C(F)(F)F)C=C2C(=O)O

DOS

IR

Vibrations