Geometry & MOs

Info

ID:	398420
PubChem CID:	135033189
Reduced:	O3C20H28 (1)
Stoich.:	A3B20C28 (1)
Weight, g/mol:	332.180771
ΔH_f, kcal/mol:	-119.95
Dipole, Da:	1.51
IP(EA), eV:	-8.79(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2aR,3aR,5S,7aR)-2a,7,7a-trimethyl-1-methylidene-5-trimethylsilyloxy-3a,4,5,8a-tetrahydro-2H-cyclobuta[b]naphthalene-3,8-dione

Drug info:

PubChemData

Smile

CC(C)C1=C2[C@H]3CC4C(=CC([C@@]3(CC[C@]2(C=C1)C)C)(O4)O)CO

DOS

IR

Vibrations