Geometry & MOs

Info

ID:	20494
PubChem CID:	584266
Reduced:	O3H6C8 (2)
Stoich.:	A3B6C8 (2)
Weight, g/mol:	300.063388
ΔH_f, kcal/mol:	-137.37
Dipole, Da:	0.96
IP(EA), eV:	-9.34(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4,11,13,15,22-hexaoxapentacyclo[12.8.0.03,12.05,10.016,21]docosa-5,7,9,16,18,20-hexaene

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)OC3C(O2)OC4C(O3)OC5=CC=CC=C5O4

DOS

IR

Vibrations