Geometry & MOs

Info

ID:	196998
PubChem CID:	78907421
Reduced:	ON4C16H18 (1)
Stoich.:	AB4C16D18 (1)
Weight, g/mol:	408.89585
ΔH_f, kcal/mol:	46.29
Dipole, Da:	1.13
IP(EA), eV:	-8.43(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-bromophenyl)-4-(4-bromophenyl)-5-methyl-1,3-thiazole

Drug info:

PubChemData

Smile

CC(=NN=C(N)N)C1=CC=C(C=C1)OCC2=CC=CC=C2

DOS

IR

Vibrations