Geometry & MOs

Info

ID:	56160
PubChem CID:	17422324
Reduced:	ON5H21C22 (1)
Stoich.:	AB5C21D22 (1)
Weight, g/mol:	340.028456
ΔH_f, kcal/mol:	82.61
Dipole, Da:	5.37
IP(EA), eV:	-9.14(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-1,3-thiazole-5-carboxylate

Drug info:

PubChemData

Smile

CN1C(=O)C2=CC=CC=C2N3C1=NN=C3CN4CCC(=CC4)C5=CC=CC=C5

DOS

IR

Vibrations