Geometry & MOs

Info

ID:	32204
PubChem CID:	6435912
Reduced:	O2C15H27 (4)
Stoich.:	A2B15C27 (4)
Weight, g/mol:	284.198759
ΔH_f, kcal/mol:	-523.11
Dipole, Da:	0.65
IP(EA), eV:	-9.4(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(E)-dodec-4-enyl]butanedioic acid

Drug info:

PubChemData

Smile

CCCCCCCC/C=C\CCCCCCCC(=O)OCC([C@@H]1[C@H]([C@@H](CO1)O)OC(=O)CCCCCCC/C=C\CCCCCCCC)OC(=O)CCCCCCC/C=C\CCCCCCCC

DOS

IR

Vibrations