Geometry & MOs

Info

ID:	267517
PubChem CID:	103582509
Reduced:	BrClN2F3H9C13 (1)
Stoich.:	ABC2D3E9F13 (1)
Weight, g/mol:	288.00289
ΔH_f, kcal/mol:	-109.71
Dipole, Da:	2.22
IP(EA), eV:	-9.06(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-3-chloro-N-(1-cyclopropylpropan-2-yl)pyridin-2-amine

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CNC2=C(C=C(C=N2)Br)Cl)C(F)(F)F

DOS

IR

Vibrations