Geometry & MOs

Info

ID:	2031
PubChem CID:	5621
Reduced:	N2O3C29H42 (1)
Stoich.:	A2B3C29D42 (1)
Weight, g/mol:	466.319543
ΔH_f, kcal/mol:	-159.17
Dipole, Da:	4.34
IP(EA), eV:	-8.42(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[6-[(3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl)amino]hexyl]pyrrolidine-2,5-dione

Drug info:

PubChemData

Smile

CC12CCC3C(C1CCC2NCCCCCCN4C(=O)CCC4=O)CCC5=C3C=CC(=C5)OC

DOS

IR

Vibrations