Geometry & MOs

Info

ID:	18283
PubChem CID:	539355
Reduced:	O6C13H20 (1)
Stoich.:	A6B13C20 (1)
Weight, g/mol:	272.125988
ΔH_f, kcal/mol:	-277.33
Dipole, Da:	2.33
IP(EA), eV:	-10.43(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl 4,4-diacetylheptanedioate

Drug info:

PubChemData

Smile

CC(=O)C(CCC(=O)OC)(CCC(=O)OC)C(=O)C

DOS

IR

Vibrations