Geometry & MOs

Info

ID:	377898
PubChem CID:	134223964
Reduced:	BrH19C24 (1)
Stoich.:	AB19C24 (1)
Weight, g/mol:	340.08266
ΔH_f, kcal/mol:	89.2
Dipole, Da:	2.63
IP(EA), eV:	-8.98(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-bromophenyl)-4-phenylbicyclo[2.2.2]octane

Drug info:

PubChemData

Smile

CC1=C(C2(C3=CC=CC=C3C1C4=CC=CC=C42)C5=CC=C(C=C5)Br)C

DOS

IR

Vibrations