Geometry & MOs

Info

ID:	430356
PubChem CID:	135170420
Reduced:	OC9H15 (2)
Stoich.:	AB9C15 (2)
Weight, g/mol:	454.171832
ΔH_f, kcal/mol:	-117.3
Dipole, Da:	0.81
IP(EA), eV:	-8.89(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,4-dimethyl-2,5-bis(5,5,6,6,6-pentafluorohexyl)benzene

Drug info:

PubChemData

Smile

CCCCOCC1=CC(=C(C=C1C)COCCCC)C

DOS

IR

Vibrations