Geometry & MOs

Info

ID:	208076
PubChem CID:	80492172
Reduced:	ClSN4C13H19 (1)
Stoich.:	ABC4D13E19 (1)
Weight, g/mol:	255.94183
ΔH_f, kcal/mol:	51.47
Dipole, Da:	2.1
IP(EA), eV:	-8.92(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-2-(1,3-thiazol-4-yl)pyrimidin-4-amine

Drug info:

PubChemData

Smile

CCC1=NN(C(=C1Cl)CC(C2=CSC=N2)NC)CC

DOS

IR

Vibrations