Geometry & MOs

Info

ID:	428535
PubChem CID:	135167586
Reduced:	O6H10C19 (1)
Stoich.:	A6B10C19 (1)
Weight, g/mol:	334.047738
ΔH_f, kcal/mol:	-132.73
Dipole, Da:	2.7
IP(EA), eV:	-8.88(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5,7,17,19-pentaoxahexacyclo[11.11.0.03,11.04,8.015,23.016,20]tetracosa-1(13),3(11),4(8),9,14,16(20),21,23-octaen-12-one

Drug info:

PubChemData

Smile

C1OC2=CC3=CC4=C(C=C3C=C2O1)OC5=CC6=C(C=C5C4=O)OCO6

DOS

IR

Vibrations