Geometry & MOs

Info

ID:	386094
PubChem CID:	134980767
Reduced:	H20C23 (1)
Stoich.:	A20B23 (1)
Weight, g/mol:	380.235145
ΔH_f, kcal/mol:	84.15
Dipole, Da:	0.71
IP(EA), eV:	-9.04(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,6-dimethoxy-4-methylphenyl)-3-(2-methoxy-4-methylphenyl)bicyclo[2.2.2]octane

Drug info:

PubChemData

Smile

C[C@@H]1[C@@]2([C@]1(C3=CC=CC=C3C2)C4=CC=CC=C4)C5=CC=CC=C5

DOS

IR

Vibrations