Geometry & MOs

Info

ID:	379846
PubChem CID:	134465049
Reduced:	F3C28H33 (1)
Stoich.:	A3B28C33 (1)
Weight, g/mol:	358.190835
ΔH_f, kcal/mol:	-91.34
Dipole, Da:	4.38
IP(EA), eV:	-8.8(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-1,2,8-trifluoro-7-(4-propylcyclohexyl)biphenylene

Drug info:

PubChemData

Smile

CCCCCC1CCC(CC1)/C=C/C2=CC3=C4C=CC(=C(C4=C3C(=C2F)F)F)CCC

DOS

IR

Vibrations