Geometry & MOs

Info

ID:	384793
PubChem CID:	134977678
Reduced:	H7F15C23 (1)
Stoich.:	A7B15C23 (1)
Weight, g/mol:	194.10955
ΔH_f, kcal/mol:	-592.9
Dipole, Da:	1.59
IP(EA), eV:	-10.62(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,4R,9R)-9-phenyltetracyclo[5.2.0.02,4.03,5]non-6-ene

Drug info:

PubChemData

Smile

C1C(CC(C1C2=C(C(=C(C(=C2F)F)F)F)F)C3=C(C(=C(C(=C3F)F)F)F)F)C4=C(C(=C(C(=C4F)F)F)F)F

DOS

IR

Vibrations