Geometry & MOs

Info

ID:	207683
PubChem CID:	80437712
Reduced:	NO2F3C15H16 (1)
Stoich.:	AB2C3D15E16 (1)
Weight, g/mol:	317.079426
ΔH_f, kcal/mol:	-223.55
Dipole, Da:	4.69
IP(EA), eV:	-8.78(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-2-(2-methylpropyl)-6-(2,2,2-trifluoroethoxy)quinoline

Drug info:

PubChemData

Smile

CC(C)CC1=CC(=O)C2=C(N1)C(=CC=C2)OCC(F)(F)F

DOS

IR

Vibrations