Geometry & MOs

Info

ID:	220524
PubChem CID:	85197656
Reduced:	Cl2C7H7 (2)
Stoich.:	A2B7C7 (2)
Weight, g/mol:	324.000825
ΔH_f, kcal/mol:	-10.56
Dipole, Da:	3.02
IP(EA), eV:	-9.64(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,4,5,5,5-pentafluoro-1-methoxy-2,3-bis(trifluoromethyl)penta-1,3-diene

Drug info:

PubChemData

Smile

C1CC2C=CC1C3C2C4(CCC3(C(=C4Cl)Cl)Cl)Cl

DOS

IR

Vibrations