Geometry & MOs

Info

ID:	340550
PubChem CID:	127262561
Reduced:	BrClH2C3N4 (1)
Stoich.:	ABC2D3E4 (1)
Weight, g/mol:	183.010248
ΔH_f, kcal/mol:	59.06
Dipole, Da:	3.33
IP(EA), eV:	-9.62(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-aminoimidazo[2,1-b][1,3]thiazole-3-carboxylic acid

Drug info:

PubChemData

Smile

C1(=C(N=NC(=N1)N)Br)Cl

DOS

IR

Vibrations