Geometry & MOs

Info

ID:	266938
PubChem CID:	103580130
Reduced:	BrClON2C10H14 (1)
Stoich.:	ABCD2E10F14 (1)
Weight, g/mol:	316.93891
ΔH_f, kcal/mol:	-30.31
Dipole, Da:	3.18
IP(EA), eV:	-8.83(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-3-chloro-N-methyl-N-(1,3-thiazol-4-ylmethyl)pyridin-2-amine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations