Geometry & MOs

Info

ID:	394617
PubChem CID:	135023291
Reduced:	OC11H12 (2)
Stoich.:	AB11C12 (2)
Weight, g/mol:	358.232807
ΔH_f, kcal/mol:	-3.71
Dipole, Da:	1.35
IP(EA), eV:	-9.44(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R,6aR)-3-but-3-enyl-4-[2-tri(propan-2-yl)silylethynyl]-1,3,6,6a-tetrahydrocyclopenta[c]furan-5-one

Drug info:

PubChemData

Smile

C=CCCC[C@@H]1C2=C(C(=O)C[C@H]2CO1)C#CCCC3=CC=CC=C3

DOS

IR

Vibrations