Geometry & MOs

Info

ID:	389494
PubChem CID:	134993298
Reduced:	H8C9 (2)
Stoich.:	A8B9 (2)
Weight, g/mol:	224.17763
ΔH_f, kcal/mol:	109.18
Dipole, Da:	0.43
IP(EA), eV:	-9.24(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (3E,6Z)-dodeca-3,6-dienoate

Drug info:

PubChemData

Smile

C\1C(/C1=C\2/CC2C3=CC=CC=C3)C4=CC=CC=C4

DOS

IR

Vibrations