Geometry & MOs

Info

ID:	5344
PubChem CID:	13005
Reduced:	OC3H4 (2)
Stoich.:	AB3C4 (2)
Weight, g/mol:	112.052429
ΔH_f, kcal/mol:	-88.24
Dipole, Da:	1.8
IP(EA), eV:	-10.19(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methylcyclopentane-1,3-dione

Drug info:

PubChemData

Smile

CC1C(=O)CCC1=O

DOS

IR

Vibrations