Geometry & MOs

Info

ID:	54849
PubChem CID:	17389395
Reduced:	BrSCl2N2H13C16 (1)
Stoich.:	ABC2D2E13F16 (1)
Weight, g/mol:	374.04523
ΔH_f, kcal/mol:	40.91
Dipole, Da:	3.55
IP(EA), eV:	-8.59(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,4-dimethylphenyl)-4-(4-methylphenyl)-1,3-thiazol-2-amine;hydrobromide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC2=NC(=CS2)C3=CC=C(C=C3)Cl)Cl.Br

DOS

IR

Vibrations