Geometry & MOs

Info

ID:	440940
PubChem CID:	135232368
Reduced:	OH18C27 (1)
Stoich.:	AB18C27 (1)
Weight, g/mol:	358.135765
ΔH_f, kcal/mol:	66.2
Dipole, Da:	1.59
IP(EA), eV:	-8.19(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-oxaheptacyclo[15.11.0.02,10.03,8.011,16.019,27.021,26]octacosa-1(17),2(10),3,5,7,11(16),14,18,21,23,25,27-dodecaene

Drug info:

PubChemData

Smile

C1CC2=C(C=C1)C3=C(C=C4C(=C3)CC5=CC=CC=C54)C6=C2C7=CC=CC=C7O6

DOS

IR

Vibrations