Geometry & MOs

Info

ID:	376342
PubChem CID:	134222353
Reduced:	O2F8H24C31 (1)
Stoich.:	A2B8C24D31 (1)
Weight, g/mol:	338.204594
ΔH_f, kcal/mol:	-400.26
Dipole, Da:	9.57
IP(EA), eV:	-9.48(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-ethenylcyclohexyl)-4-[2-[4-(fluoromethoxy)phenyl]ethyl]benzene

Drug info:

PubChemData

Smile

CCCCCC1=CC=C(C=C1)C2=CC(=C(C=C2)C3=CC(=C(C(=C3)F)C(OC4=CC(=C(C(=C4)F)OCF)F)(F)F)F)F

DOS

IR

Vibrations