Geometry & MOs

Info

ID:	277547
PubChem CID:	103829336
Reduced:	BrSN2O2C9H13 (1)
Stoich.:	ABC2D2E9F13 (1)
Weight, g/mol:	276.048797
ΔH_f, kcal/mol:	-68.34
Dipole, Da:	4.5
IP(EA), eV:	-9.41(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-chlorophenyl)-2,3,6-trimethylimidazo[2,1-b][1,3]thiazole

Drug info:

PubChemData

Smile

CC(C)(C)S(=O)(=O)NC1=CN=C(C=C1)Br

DOS

IR

Vibrations