Geometry & MOs

Info

ID:	264219
PubChem CID:	103442627
Reduced:	ClON4C12H15 (1)
Stoich.:	ABC4D12E15 (1)
Weight, g/mol:	237.996762
ΔH_f, kcal/mol:	39.76
Dipole, Da:	2.37
IP(EA), eV:	-9.36(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-chloropyridin-2-yl)-2-(1,3-thiazol-5-yl)ethanone

Drug info:

PubChemData

Smile

CCNC(C)(C)C1=NC(=NO1)C2=C(C=CC=N2)Cl

DOS

IR

Vibrations