Geometry & MOs

Info

ID:	188900
PubChem CID:	77781005
Reduced:	NO4C29H41 (1)
Stoich.:	AB4C29D41 (1)
Weight, g/mol:	504.381475
ΔH_f, kcal/mol:	-212.2
Dipole, Da:	5.55
IP(EA), eV:	-8.83(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

12-[(17-hydroxy-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-11-yl)oxy]dodecanoic acid

Drug info:

PubChemData

Smile

CC12CCC(=O)CC1CCC3C2C(CC4(C3CCC4O)C)C5=CC=C(C=C5)OCCCC(=O)N

DOS

IR

Vibrations