Geometry & MOs

Info

ID:	227585
PubChem CID:	87562045
Reduced:	OC11H21 (4)
Stoich.:	AB11C21 (4)
Weight, g/mol:	676.636961
ΔH_f, kcal/mol:	-338.77
Dipole, Da:	2.66
IP(EA), eV:	-10.46(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

bis(5-propan-2-ylheptadecyl) (E)-but-2-enedioate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCC(CCCCOC(=O)/C=C\C(=O)OCCCCC(CCCCCCCCCCCC)C(C)C)C(C)C

DOS

IR

Vibrations