Geometry & MOs

Info

ID:	271813
PubChem CID:	103692969
Reduced:	BrClNC9H9 (1)
Stoich.:	ABCD9E9 (1)
Weight, g/mol:	220.082347
ΔH_f, kcal/mol:	31.92
Dipole, Da:	1.43
IP(EA), eV:	-9.52(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3,3-trifluoro-1-(6-methoxypyridin-2-yl)propan-1-amine

Drug info:

PubChemData

Smile

C=CC(C1=C(C=C(C=C1)Cl)Br)N

DOS

IR

Vibrations