Geometry & MOs

Info

ID:	303730
PubChem CID:	124490108
Reduced:	SN4O5C20H28 (1)
Stoich.:	AB4C5D20E28 (1)
Weight, g/mol:	288.172545
ΔH_f, kcal/mol:	-183.48
Dipole, Da:	2.81
IP(EA), eV:	-9.6(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(8R,9S,10S,11R,13S,14S)-11-hydroxy-13-methyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-3,17-dione

Drug info:

PubChemData

Smile

C[C@H]1CCCCN1S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)N=C3)CC(=O)NCCCOC

DOS

IR

Vibrations