Geometry & MOs

Info

ID:	225085
PubChem CID:	85741500
Reduced:	O2N3H19C28 (1)
Stoich.:	A2B3C19D28 (1)
Weight, g/mol:	354.87034
ΔH_f, kcal/mol:	59.74
Dipole, Da:	1.94
IP(EA), eV:	-9.18(-1.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[bromo(difluoro)methyl]sulfanyl-5-chloro-4-phenyl-1,3-thiazole

Drug info:

PubChemData

Smile

C1C2=C(CC3=C1C(=NC(=N3)C4=CC=CC=C4)C5=CC=CC=C5)C(=O)N(C2=O)C6=CC=CC=C6

DOS

IR

Vibrations