Geometry & MOs

Info

ID:	227536
PubChem CID:	87561948
Reduced:	O5C22H40 (1)
Stoich.:	A5B22C40 (1)
Weight, g/mol:	562.979215
ΔH_f, kcal/mol:	-268.6
Dipole, Da:	6.71
IP(EA), eV:	-9.6(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.CCC(C(=O)O)O

DOS

IR

Vibrations