Geometry & MOs

Info

ID:	233607
PubChem CID:	91145683
Reduced:	NO2C8H14 (2)
Stoich.:	AB2C8D14 (2)
Weight, g/mol:	399.240959
ΔH_f, kcal/mol:	-185.73
Dipole, Da:	6.75
IP(EA), eV:	-9.5(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(10R,11S,13S,17R)-10,13-dimethyl-3,5'-dioxospiro[2,4,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-17,2'-pyrrolidine]-11-yl] acetate

Drug info:

PubChemData

Smile

CCCCCCOCCC1=NC(=O)C(=C(N1)C(O)OC)CC

DOS

IR

Vibrations