Geometry & MOs

Info

ID:	216647
PubChem CID:	85086557
Reduced:	ON6C14H20 (1)
Stoich.:	AB6C14D20 (1)
Weight, g/mol:	288.152558
ΔH_f, kcal/mol:	71.43
Dipole, Da:	4.83
IP(EA), eV:	-8.62(-1.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

11-fluoro-3-hydroxy-7-methyl-6,7,8,9,11,12,13,14,15,16-decahydrocyclopenta[a]phenanthren-17-one

Drug info:

PubChemData

Smile

CCCCCN=C(N)NNC=C1C2=CC(=O)C=CC2=NN1

DOS

IR

Vibrations