Geometry & MOs

Info

ID:	382848
PubChem CID:	134974236
Reduced:	OC9H11 (2)
Stoich.:	AB9C11 (2)
Weight, g/mol:	270.16198
ΔH_f, kcal/mol:	-21.46
Dipole, Da:	4.64
IP(EA), eV:	-8.3(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(10R,13S)-13-methyl-1,2,6,7,8,9,10,14,15,16-decahydrocyclopenta[a]phenanthrene-3,17-dione

Drug info:

PubChemData

Smile

C[C@]12CC=C3[C@H]4CCC(=O)C=C4CCC3C1CCC2=O

DOS

IR

Vibrations