Geometry & MOs

Info

ID:	248763
PubChem CID:	103084194
Reduced:	BrNSC12H12 (1)
Stoich.:	ABCD12E12 (1)
Weight, g/mol:	295.00303
ΔH_f, kcal/mol:	39.38
Dipole, Da:	2.31
IP(EA), eV:	-9.14(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-bromo-2-methylphenyl)-4-propyl-1,3-thiazole

Drug info:

PubChemData

Smile

CCC1=CSC(=N1)C2=C(C=C(C=C2)Br)C

DOS

IR

Vibrations