Geometry & MOs

Info

ID:	3550
PubChem CID:	9781
Reduced:	FO3C22H31 (1)
Stoich.:	AB3C22D31 (1)
Weight, g/mol:	362.225723
ΔH_f, kcal/mol:	-184.35
Dipole, Da:	7.28
IP(EA), eV:	-9.77(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

17-acetyl-9-fluoro-11-hydroxy-6,10,13-trimethyl-2,6,7,8,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-one

Drug info:

PubChemData

Smile

CC1CC2C3CCC(C3(CC(C2(C4(C1=CC(=O)CC4)C)F)O)C)C(=O)C

DOS

IR

Vibrations