Geometry & MOs

Info

ID:	266899
PubChem CID:	103579957
Reduced:	BrClSN2H8C10 (1)
Stoich.:	ABCD2E8F10 (1)
Weight, g/mol:	313.96217
ΔH_f, kcal/mol:	56.39
Dipole, Da:	2.74
IP(EA), eV:	-8.78(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-3-chloro-N-[(2-fluorophenyl)methyl]pyridin-2-amine

Drug info:

PubChemData

Smile

C1=CSC(=C1)CNC2=C(C=C(C=N2)Br)Cl

DOS

IR

Vibrations