Geometry & MOs

Info

ID:	6257
PubChem CID:	67668
Reduced:	ClNF3H5C10 (1)
Stoich.:	ABC3D5E10 (1)
Weight, g/mol:	231.006261
ΔH_f, kcal/mol:	-119.61
Dipole, Da:	3.59
IP(EA), eV:	-9.93(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-7-(trifluoromethyl)quinoline

Drug info:

PubChemData

Smile

C1=CC2=C(C=CN=C2C=C1C(F)(F)F)Cl

DOS

IR

Vibrations