Geometry & MOs

Info

ID:	8533
PubChem CID:	78939
Reduced:	O4C13H24 (1)
Stoich.:	A4B13C24 (1)
Weight, g/mol:	244.167459
ΔH_f, kcal/mol:	-217.38
Dipole, Da:	3.29
IP(EA), eV:	-10.53(0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diethyl 2-butan-2-yl-2-ethylpropanedioate

Drug info:

PubChemData

Smile

CCC(C)C(CC)(C(=O)OCC)C(=O)OCC

DOS

IR

Vibrations