Geometry & MOs

Info

ID:	379811
PubChem CID:	134464965
Reduced:	O2F3C19H19 (1)
Stoich.:	A2B3C19D19 (1)
Weight, g/mol:	404.196315
ΔH_f, kcal/mol:	-140.73
Dipole, Da:	1.49
IP(EA), eV:	-8.54(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-ethoxy-1,2,8-trifluoro-3-[(4-propylcyclohexyl)methoxy]biphenylene

Drug info:

PubChemData

Smile

CCCCCOC1=C(C2=C3C(=C2C=C1)C=C(C(=C3F)F)OCC)F

DOS

IR

Vibrations