Geometry & MOs

Info

ID:	441895
PubChem CID:	135246543
Reduced:	BrON4C13H15 (1)
Stoich.:	ABC4D13E15 (1)
Weight, g/mol:	253.071448
ΔH_f, kcal/mol:	43.09
Dipole, Da:	1.77
IP(EA), eV:	-8.56(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-2-[4-(trifluoromethyl)phenoxy]pyridine

Drug info:

PubChemData

Smile

CCCN(C)C1=NC=C(C=N1)OC2=C(C=CC=N2)Br

DOS

IR

Vibrations