Geometry & MOs

Info

ID:	54770
PubChem CID:	17389238
Reduced:	BrOSF2N2H11C16 (1)
Stoich.:	ABCD2E2F11G16 (1)
Weight, g/mol:	454.01508
ΔH_f, kcal/mol:	-61.73
Dipole, Da:	1.68
IP(EA), eV:	-9.46(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-fluorophenyl)-4-(4-phenylphenyl)-1,3-thiazole-2-carboxamide;hydrobromide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C2=CSC(=N2)C(=O)NC3=CC=C(C=C3)F)F.Br

DOS

IR

Vibrations