Geometry & MOs

Info

ID:	383900
PubChem CID:	134975940
Reduced:	OSiC16H26 (1)
Stoich.:	ABC16D26 (1)
Weight, g/mol:	238.156895
ΔH_f, kcal/mol:	-83.08
Dipole, Da:	0.33
IP(EA), eV:	-9.18(0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,3R,4R,6R)-1-(methoxymethoxy)-3-methyl-6-prop-1-en-2-ylbicyclo[2.2.2]octan-2-one

Drug info:

PubChemData

Smile

CC[Si](CC)(CC)O/C=C\CCC1=CC=CC=C1

DOS

IR

Vibrations