Geometry & MOs

Info

ID:	389745
PubChem CID:	134994963
Reduced:	OC6H10 (2)
Stoich.:	AB6C10 (2)
Weight, g/mol:	178.09938
ΔH_f, kcal/mol:	-48.14
Dipole, Da:	3.05
IP(EA), eV:	-8.75(0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl nona-2,4-diynoate

Drug info:

PubChemData

Smile

CO/C(=C(/CCC=C)\OC)/CCC=C

DOS

IR

Vibrations