Geometry & MOs

Info

ID:	18161
PubChem CID:	538605
Reduced:	OC4H6 (2)
Stoich.:	AB4C6 (2)
Weight, g/mol:	140.08373
ΔH_f, kcal/mol:	-87.5
Dipole, Da:	2.32
IP(EA), eV:	-9.92(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methylideneheptane-2,6-dione

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations