Geometry & MOs

Info

ID:	36348
PubChem CID:	8002033
Reduced:	ClSN3O4C16H16 (1)
Stoich.:	ABC3D4E16F16 (1)
Weight, g/mol:	333.114713
ΔH_f, kcal/mol:	-53.32
Dipole, Da:	5.83
IP(EA), eV:	-9.54(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methylphenyl)-2-[(5S)-2-morpholin-4-yl-4-oxo-1,3-thiazol-5-yl]acetamide

Drug info:

PubChemData

Smile

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)NC3=CC(=CC=C3)Cl)[N+](=O)[O-]

DOS

IR

Vibrations