Geometry & MOs

Info

ID:	379827
PubChem CID:	134465005
Reduced:	FC8H9 (3)
Stoich.:	AB8C9 (3)
Weight, g/mol:	388.165014
ΔH_f, kcal/mol:	-92.73
Dipole, Da:	4.13
IP(EA), eV:	-8.8(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(6-ethoxy-3,4,5-trifluorobiphenylen-2-yl)cyclohexyl]propan-1-one

Drug info:

PubChemData

Smile

CCCC1CCC(CC1)C2=CC3=C4C=CC(=C(C4=C3C(=C2F)F)F)CCC

DOS

IR

Vibrations