Geometry & MOs

Info

ID:	159419
PubChem CID:	57280120
Reduced:	O7C18H32 (1)
Stoich.:	A7B18C32 (1)
Weight, g/mol:	294.016438
ΔH_f, kcal/mol:	-361.96
Dipole, Da:	3.3
IP(EA), eV:	-10.47(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,12-dioxatetracyclo[12.3.1.05,10.07,15]octadeca-1(18),5(10),6,8,14,16-hexaene-2,4,11,13-tetrone

Drug info:

PubChemData

Smile

CCCCC(C(=O)O)OC(CCCC)C(=O)OC(CCCC)C(=O)O

DOS

IR

Vibrations