Geometry & MOs

Info

ID:	142339
PubChem CID:	53019164
Reduced:	SO3N6H18C22 (1)
Stoich.:	AB3C6D18E22 (1)
Weight, g/mol:	428.070989
ΔH_f, kcal/mol:	61.98
Dipole, Da:	6.67
IP(EA), eV:	-9.25(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-chlorophenyl)-N-(3-ethyl-7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)-5-methyl-1,2-oxazole-4-carboxamide

Drug info:

PubChemData

Smile

CN1C2=C(CN(CC2)S(=O)(=O)C3=CC=CC(=C3)C#N)C(=N1)C4=NN=C(O4)C5=CC=CC=C5

DOS

IR

Vibrations