Geometry & MOs

Info

ID:	231936
PubChem CID:	87574952
Reduced:	O2C6H7 (2)
Stoich.:	A2B6C7 (2)
Weight, g/mol:	329.287582
ΔH_f, kcal/mol:	-143.63
Dipole, Da:	6.25
IP(EA), eV:	-9.26(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)CCC(=O)OC)C=O

DOS

IR

Vibrations