Geometry & MOs

Info

ID:	266975
PubChem CID:	103580278
Reduced:	BrClF3N5H8C11 (1)
Stoich.:	ABC3D5E8F11 (1)
Weight, g/mol:	291.9978
ΔH_f, kcal/mol:	-69.15
Dipole, Da:	6.36
IP(EA), eV:	-9.74(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(5-bromo-3-chloropyridin-2-yl)amino]pentan-1-ol

Drug info:

PubChemData

Smile

C1CN2C(=NN=C2C(F)(F)F)CN1C3=C(C=C(C=N3)Br)Cl

DOS

IR

Vibrations