Geometry & MOs

Info

ID:	225236
PubChem CID:	85752766
Reduced:	O2C13H22 (2)
Stoich.:	A2B13C22 (2)
Weight, g/mol:	280.012297
ΔH_f, kcal/mol:	-261.9
Dipole, Da:	3.53
IP(EA), eV:	-9.91(0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,2,4,5-tetrafluoro-3-(3,4,5-trifluorophenyl)benzene

Drug info:

PubChemData

Smile

CC(CCCO)C1CCC2C1(C(CC3C2CCC4C3(CCC(C4)OC(=O)C)C)O)C

DOS

IR

Vibrations