Geometry & MOs

Info

ID:	2570
PubChem CID:	7940
Reduced:	O3C5H6 (1)
Stoich.:	A3B5C6 (1)
Weight, g/mol:	114.031694
ΔH_f, kcal/mol:	-130.1
Dipole, Da:	6.52
IP(EA), eV:	-11.26(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

oxane-2,6-dione

Drug info:

PubChemData

Smile

C1CC(=O)OC(=O)C1

DOS

IR

Vibrations