Geometry & MOs

Info

ID:	288409
PubChem CID:	104316383
Reduced:	ClSBr2N2H5C9 (1)
Stoich.:	ABC2D2E5F9 (1)
Weight, g/mol:	395.87545
ΔH_f, kcal/mol:	59.96
Dipole, Da:	1.93
IP(EA), eV:	-9.23(-1.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-bromophenyl)-2-(3-bromopyridin-2-yl)-1,3-thiazole

Drug info:

PubChemData

Smile

C1=C(C=NC(=C1Br)C2=NC=C(S2)CCl)Br

DOS

IR

Vibrations