Geometry & MOs

Info

ID:	411665
PubChem CID:	135084499
Reduced:	O3C12H16 (1)
Stoich.:	A3B12C16 (1)
Weight, g/mol:	242.133821
ΔH_f, kcal/mol:	-86.69
Dipole, Da:	3.43
IP(EA), eV:	-10.1(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC(=O)C(CC=C)C(=O)OCCC=C=C

DOS

IR

Vibrations