Geometry & MOs

Info

ID:	402136
PubChem CID:	135054570
Reduced:	OC4H5 (4)
Stoich.:	AB4C5 (4)
Weight, g/mol:	354.180665
ΔH_f, kcal/mol:	-152.63
Dipole, Da:	2.82
IP(EA), eV:	-9.72(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(8R,9S,13S,14S,17S)-3-methoxy-13-methyl-17-(trifluoromethyl)-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-ol

Drug info:

PubChemData

Smile

CCOC(=O)C1[C@](COC1(C2=CC=CC=C2)O)(C)C=C

DOS

IR

Vibrations