Geometry & MOs

Info

ID:	402980
PubChem CID:	135058150
Reduced:	OH16C19 (1)
Stoich.:	AB16C19 (1)
Weight, g/mol:	254.071863
ΔH_f, kcal/mol:	18.21
Dipole, Da:	1.49
IP(EA), eV:	-8.69(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-fluoro-2-(3-methylphenyl)-4-(trifluoromethyl)benzene

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C2=CC=CC=C2)C3=CC=CC=C3O

DOS

IR

Vibrations