Geometry & MOs

Info

ID:	18887
PubChem CID:	550297
Reduced:	OC8H14 (2)
Stoich.:	AB8C14 (2)
Weight, g/mol:	252.20893
ΔH_f, kcal/mol:	-122.59
Dipole, Da:	1.51
IP(EA), eV:	-9.09(0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3,7,11-trimethyldodeca-6,10-dienoate

Drug info:

PubChemData

Smile

CC(CCC=C(C)CCC=C(C)C)CC(=O)OC

DOS

IR

Vibrations