Geometry & MOs

Info

ID:	722
PubChem CID:	3264
Reduced:	O2C11H14 (2)
Stoich.:	A2B11C14 (2)
Weight, g/mol:	356.198759
ΔH_f, kcal/mol:	-194.55
Dipole, Da:	2.82
IP(EA), eV:	-8.93(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-acetyloxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl) acetate

Drug info:

PubChemData

Smile

CC(=O)OC1CCC2C1(CCC3C2CCC4=C3C=CC(=C4)OC(=O)C)C

DOS

IR

Vibrations