Geometry & MOs

Info

ID:	132491
PubChem CID:	51370258
Reduced:	OSN2H18C22 (1)
Stoich.:	ABC2D18E22 (1)
Weight, g/mol:	420.02958
ΔH_f, kcal/mol:	85.3
Dipole, Da:	2.96
IP(EA), eV:	-8.96(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(4-bromophenyl)methyl]-N,4-diphenyl-1,3-thiazol-2-imine

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2=NN=C(S2)C(C3=CC=CC=C3)C4=CC=CC=C4

DOS

IR

Vibrations