Geometry & MOs

Info

ID:	386778
PubChem CID:	134982908
Reduced:	NOC16H17 (1)
Stoich.:	ABC16D17 (1)
Weight, g/mol:	584.29266
ΔH_f, kcal/mol:	15.07
Dipole, Da:	3.82
IP(EA), eV:	-9.27(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1E,3E,5E,7E)-1,3,5,7-tetrakis[(4-methylphenoxy)methyl]cycloocta-1,3,5,7-tetraene

Drug info:

PubChemData

Smile

C=C=C1CC[C@H]2C[C@@H]1N(C2=O)CC3=CC=CC=C3

DOS

IR

Vibrations