Geometry & MOs

Info

ID:	228129
PubChem CID:	87563500
Reduced:	OC4H9 (2)
Stoich.:	AB4C9 (2)
Weight, g/mol:	244.167459
ΔH_f, kcal/mol:	-132.6
Dipole, Da:	3.82
IP(EA), eV:	-10.0(0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-di(pentan-2-yl)propanedioic acid

Drug info:

PubChemData

Smile

CCCCCCC(=O)C.O

DOS

IR

Vibrations