Geometry & MOs

Info

ID:	127623
PubChem CID:	51009004
Reduced:	OC6H8 (2)
Stoich.:	AB6C8 (2)
Weight, g/mol:	290.188195
ΔH_f, kcal/mol:	-66.95
Dipole, Da:	1.92
IP(EA), eV:	-9.59(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,2R,6R,8S)-11-ethenyl-4,4,8-triethyl-3,5-dioxatricyclo[6.3.1.02,6]dodec-10-en-7-one

Drug info:

PubChemData

Smile

C[C@@H]1C[C@@H]2C=C[C@@]([C@H]2CC=O)(C1=O)C

DOS

IR

Vibrations