Geometry & MOs

Info

ID:	18306
PubChem CID:	539516
Reduced:	O4C23H32 (1)
Stoich.:	A4B23C32 (1)
Weight, g/mol:	372.23006
ΔH_f, kcal/mol:	-204.5
Dipole, Da:	3.64
IP(EA), eV:	-9.8(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4,4,10,13-tetramethyl-3,7-dioxo-1,2,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl) acetate

Drug info:

PubChemData

Smile

CC(=O)OC1CCC2C1(CCC3C2C(=O)C=C4C3(CCC(=O)C4(C)C)C)C

DOS

IR

Vibrations