Geometry & MOs

Info

ID:	276215
PubChem CID:	103821296
Reduced:	ClON3C13H20 (1)
Stoich.:	ABC3D13E20 (1)
Weight, g/mol:	326.024039
ΔH_f, kcal/mol:	-32.74
Dipole, Da:	4.76
IP(EA), eV:	-9.65(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-5-nitro-N-(4-propan-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CCCCCN(C(C)C)C(=O)C1=CN=C(C=N1)Cl

DOS

IR

Vibrations