Geometry & MOs

Info

ID:	386032
PubChem CID:	134980581
Reduced:	OSiC27H30 (1)
Stoich.:	ABC27D30 (1)
Weight, g/mol:	440.238516
ΔH_f, kcal/mol:	44.12
Dipole, Da:	1.98
IP(EA), eV:	-9.15(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3bR,5aS,9aS,9bS,11R)-3b,6,6,9a-tetramethyl-11-(4-methylphenyl)sulfonyl-5,5a,7,8,9,9b,10,11-octahydro-4H-naphtho[1,2-g][1]benzofuran

Drug info:

PubChemData

Smile

CC1=C([C@@H]1COC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)[Si](C)(C)C

DOS

IR

Vibrations