Geometry & MOs

Info

ID:	445559
PubChem CID:	135268074
Reduced:	ClF3C11H14 (1)
Stoich.:	AB3C11D14 (1)
Weight, g/mol:	184.026662
ΔH_f, kcal/mol:	-164.69
Dipole, Da:	1.82
IP(EA), eV:	-9.21(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2E,4E)-5-chloro-1,1,1-trifluoro-4-methylhexa-2,4-diene

Drug info:

PubChemData

Smile

CC/C=C/C(=C(/C)\C=C(/C)\C(F)(F)F)/Cl

DOS

IR

Vibrations