Geometry & MOs

Info

ID:	385133
PubChem CID:	134978382
Reduced:	O8C25H34 (1)
Stoich.:	A8B25C34 (1)
Weight, g/mol:	952.482036
ΔH_f, kcal/mol:	-229.15
Dipole, Da:	6.31
IP(EA), eV:	-9.2(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

octaethyl cyclooctacosa-3,8,17,22-tetrayne-1,1,6,6,15,15,20,20-octacarboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1(CCCCC#CCC(CC#CC1)(C(=O)OCC)C(=O)OCC)C(=O)OCC

DOS

IR

Vibrations