Geometry & MOs

Info

ID:	220566
PubChem CID:	85197841
Reduced:	NO4C19H25 (1)
Stoich.:	AB4C19D25 (1)
Weight, g/mol:	332.178773
ΔH_f, kcal/mol:	-150.0
Dipole, Da:	0.99
IP(EA), eV:	-9.29(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-3,17-dimethoxy-13-methyl-8,9,11,12,14,15,16,17-octahydro-7H-cyclopenta[a]phenanthren-6-one

Drug info:

PubChemData

Smile

CC1(OCC(C(O1)C#CC2=CC=CC=C2)NC(=O)OC(C)(C)C)C

DOS

IR

Vibrations