Geometry & MOs

Info

ID:	232113
PubChem CID:	87575546
Reduced:	OC4H6 (3)
Stoich.:	AB4C6 (3)
Weight, g/mol:	244.185857
ΔH_f, kcal/mol:	-72.47
Dipole, Da:	3.66
IP(EA), eV:	-10.18(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCC(C=C)OC(=O)C1CCC2C(C1)O2

DOS

IR

Vibrations