Geometry & MOs

Info

ID:	228873
PubChem CID:	87566027
Reduced:	O9C11H22 (1)
Stoich.:	A9B11C22 (1)
Weight, g/mol:	252.120903
ΔH_f, kcal/mol:	-404.19
Dipole, Da:	5.3
IP(EA), eV:	-10.15(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-butoxybutanedioic acid;ethane-1,2-diol

Drug info:

PubChemData

Smile

COC(CC(=O)O)C(=O)O.C(COCCOCCO)O

DOS

IR

Vibrations