Geometry & MOs

Info

ID:	217932
PubChem CID:	85088606
Reduced:	O2C13H18 (2)
Stoich.:	A2B13C18 (2)
Weight, g/mol:	412.137816
ΔH_f, kcal/mol:	-168.36
Dipole, Da:	3.2
IP(EA), eV:	-8.96(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCOC(=O)C(CC=C(C)CCC=C(C)CCC=C(C)C)C(=O)C1=CC=CC=C1O

DOS

IR

Vibrations