Geometry & MOs

Info

ID:	382747
PubChem CID:	134974073
Reduced:	O3C11H12 (1)
Stoich.:	A3B11C12 (1)
Weight, g/mol:	306.199508
ΔH_f, kcal/mol:	-74.63
Dipole, Da:	3.37
IP(EA), eV:	-9.62(-1.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(7R,10R,11S,13S,17S)-11-fluoro-17-hydroxy-7,13-dimethyl-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-one

Drug info:

PubChemData

Smile

CC(=O)/C=C/C=C/C=C/C=C/C(=O)O

DOS

IR

Vibrations