Geometry & MOs

Info

ID:	288329
PubChem CID:	104315058
Reduced:	Br2N4C13H14 (1)
Stoich.:	A2B4C13D14 (1)
Weight, g/mol:	403.95336
ΔH_f, kcal/mol:	70.68
Dipole, Da:	1.41
IP(EA), eV:	-8.53(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,5-dibromopyridin-2-yl)-4,4,4-trifluoro-N-propylbutan-1-amine

Drug info:

PubChemData

Smile

CCCNC(C1=NC=CN=C1)C2=C(C=C(C=N2)Br)Br

DOS

IR

Vibrations