Geometry & MOs

Info

ID:	4924
PubChem CID:	12285
Reduced:	O3C7H10 (1)
Stoich.:	A3B7C10 (1)
Weight, g/mol:	142.062994
ΔH_f, kcal/mol:	-137.24
Dipole, Da:	1.69
IP(EA), eV:	-10.42(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

heptane-2,4,6-trione

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations