Geometry & MOs

Info

ID:	385705
PubChem CID:	134979786
Reduced:	CH (26)
Stoich.:	AB (26)
Weight, g/mol:	106.07825
ΔH_f, kcal/mol:	69.2
Dipole, Da:	0.6
IP(EA), eV:	-9.1(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6S,8R)-tetracyclo[3.3.0.02,8.04,6]octane

Drug info:

PubChemData

Smile

C[C@@]12CC3=CC=CC=C3C([C@@]1([C@H]2C4=CC=CC=C4)C5=CC=CC=C5)(C)C

DOS

IR

Vibrations