Geometry & MOs

Info

ID:	23003
PubChem CID:	600753
Reduced:	IH2C8F13 (1)
Stoich.:	AB2C8D13 (1)
Weight, g/mol:	471.89936
ΔH_f, kcal/mol:	-630.22
Dipole, Da:	2.0
IP(EA), eV:	-10.4(-1.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,4,5,5,6,6,6-heptafluoro-1-iodo-3,3-bis(trifluoromethyl)hex-1-ene

Drug info:

PubChemData

Smile

C(=CI)C(C(C(C(F)(F)F)(F)F)(F)F)(C(F)(F)F)C(F)(F)F

DOS

IR

Vibrations