Geometry & MOs

Info

ID:	295566
PubChem CID:	117534339
Reduced:	OSN3C12H13 (1)
Stoich.:	ABC3D12E13 (1)
Weight, g/mol:	268.007326
ΔH_f, kcal/mol:	26.04
Dipole, Da:	3.38
IP(EA), eV:	-8.57(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3-chlorophenyl)-2-(methylamino)-1,3-thiazole-4-carboxylic acid

Drug info:

PubChemData

Smile

CC(=O)C1=C(SC(=N1)N(C)C)C2=CC=CC=N2

DOS

IR

Vibrations