Geometry & MOs

Info

ID:	229370
PubChem CID:	87567493
Reduced:	O2C12H23 (2)
Stoich.:	A2B12C23 (2)
Weight, g/mol:	398.33961
ΔH_f, kcal/mol:	-272.21
Dipole, Da:	8.92
IP(EA), eV:	-10.4(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

bis(2-ethylbutyl) dodecanedioate

Drug info:

PubChemData

Smile

CCC(CC)CC(CCCCCCCCCC(=O)O)(CC(CC)CC)C(=O)O

DOS

IR

Vibrations