Geometry & MOs

Info

ID:	186215
PubChem CID:	77405405
Reduced:	FNOC24H30 (1)
Stoich.:	ABCD24E30 (1)
Weight, g/mol:	496.200749
ΔH_f, kcal/mol:	73.68
Dipole, Da:	3.33
IP(EA), eV:	-8.82(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,1,1-trifluoro-N-[5-(3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-17-yl)pyridin-3-yl]methanesulfonamide

Drug info:

PubChemData

Smile

CC12CCC(CC1=CCC3C2CCC4(C3CC=C4C5=CC(=CN=C5)F)C)O

DOS

IR

Vibrations