Geometry & MOs

Info

ID:	715
PubChem CID:	3247
Reduced:	OC9H10 (2)
Stoich.:	AB9C10 (2)
Weight, g/mol:	268.14633
ΔH_f, kcal/mol:	-74.51
Dipole, Da:	2.72
IP(EA), eV:	-8.79(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-hydroxy-13-methyl-9,11,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-17-one

Drug info:

PubChemData

Smile

CC12CCC3C(=CCC4=C3C=CC(=C4)O)C1CCC2=O

DOS

IR

Vibrations