Geometry & MOs

Info

ID:	18218
PubChem CID:	538948
Reduced:	OC18H30 (1)
Stoich.:	AB18C30 (1)
Weight, g/mol:	262.229666
ΔH_f, kcal/mol:	-83.93
Dipole, Da:	3.55
IP(EA), eV:	-8.78(0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methyl-8-(2,6,6-trimethylcyclohexen-1-yl)oct-5-en-2-one

Drug info:

PubChemData

Smile

CC1=C(C(CCC1)(C)C)CCC(=CCCC(=O)C)C

DOS

IR

Vibrations