Geometry & MOs

Info

ID:	54764
PubChem CID:	17389224
Reduced:	BrCl2N2O2S2H15C16 (1)
Stoich.:	AB2C2D2E2F15G16 (1)
Weight, g/mol:	568.00455
ΔH_f, kcal/mol:	-38.22
Dipole, Da:	3.16
IP(EA), eV:	-8.49(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(5-chlorothiophen-2-yl)-N-(4-phenoxyphenyl)-3-(2-phenylethyl)-1,3-thiazol-2-imine;hydrobromide

Drug info:

PubChemData

Smile

CN1C(=CSC1=NC2=CC(=C(C=C2OC)Cl)OC)C3=CC=C(S3)Cl.Br

DOS

IR

Vibrations