Geometry & MOs

Info

ID:	386841
PubChem CID:	134983110
Reduced:	OC11H20 (1)
Stoich.:	AB11C20 (1)
Weight, g/mol:	362.264107
ΔH_f, kcal/mol:	-47.96
Dipole, Da:	2.91
IP(EA), eV:	-8.9(0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(E)-3-[tert-butyl(dimethyl)silyl]oxyoct-1-enyl]-4,5,6,6a-tetrahydro-1H-pentalen-2-one

Drug info:

PubChemData

Smile

CCCCC/C=C\C(=C)OCC

DOS

IR

Vibrations