Geometry & MOs

Info

ID:	379831
PubChem CID:	134465013
Reduced:	F2H12C13 (2)
Stoich.:	A2B12C13 (2)
Weight, g/mol:	400.2014
ΔH_f, kcal/mol:	-107.23
Dipole, Da:	4.5
IP(EA), eV:	-9.02(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-ethoxy-1,2,8-trifluoro-3-(4-pentylcyclohexen-1-yl)biphenylene

Drug info:

PubChemData

Smile

CCCCCC1=C(C=C(C=C1)C2=CC3=C4C=CC(=C(C4=C3C(=C2F)F)F)CCC)F

DOS

IR

Vibrations