Geometry & MOs

Info

ID:	383121
PubChem CID:	134974674
Reduced:	O3C12H20 (1)
Stoich.:	A3B12C20 (1)
Weight, g/mol:	370.250795
ΔH_f, kcal/mol:	-160.76
Dipole, Da:	1.51
IP(EA), eV:	-9.12(0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2E,10E)-2,6,10-trimethyl-12-phenylmethoxydodeca-2,6,10-trienyl] acetate

Drug info:

PubChemData

Smile

CC1=CCC(CC1)[C@@](C)(COC(=O)C)O

DOS

IR

Vibrations