Geometry & MOs

Info

ID:	381161
PubChem CID:	134971812
Reduced:	BrOF3C14H14 (1)
Stoich.:	ABC3D14E14 (1)
Weight, g/mol:	296.1388
ΔH_f, kcal/mol:	-144.55
Dipole, Da:	2.77
IP(EA), eV:	-9.71(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(E)-3-(1-cyclohex-2-en-1-yl-2,2,2-trifluoroethoxy)prop-1-enyl]benzene

Drug info:

PubChemData

Smile

C=CC(C1=CC=CC=C1)C(C(F)(F)F)OCC(=C)Br

DOS

IR

Vibrations