Geometry & MOs

Info

ID:	267534
PubChem CID:	103582652
Reduced:	BrClSN2C11H16 (1)
Stoich.:	ABCD2E11F16 (1)
Weight, g/mol:	288.00289
ΔH_f, kcal/mol:	3.55
Dipole, Da:	3.11
IP(EA), eV:	-8.7(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-3-chloro-N-(3-cyclopropylpropyl)pyridin-2-amine

Drug info:

PubChemData

Smile

CCSCCC(C)NC1=C(C=C(C=N1)Br)Cl

DOS

IR

Vibrations