Geometry & MOs

Info

ID:	4043
PubChem CID:	10632
Reduced:	OC10H16 (2)
Stoich.:	AB10C16 (2)
Weight, g/mol:	304.24023
ΔH_f, kcal/mol:	-142.89
Dipole, Da:	4.04
IP(EA), eV:	-9.23(1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(17S)-10,13,17-trimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-3,17-diol

Drug info:

PubChemData

Smile

C[C@@]1(CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)O

DOS

IR

Vibrations