Geometry & MOs

Info

ID:	54353
PubChem CID:	17100321
Reduced:	OSN4H14C16 (1)
Stoich.:	ABC4D14E16 (1)
Weight, g/mol:	349.945032
ΔH_f, kcal/mol:	33.49
Dipole, Da:	5.79
IP(EA), eV:	-8.82(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2,2-trichloro-N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]acetamide

Drug info:

PubChemData

Smile

CC(=O)NC(=S)NC1=CC=CC(=C1)C2=NC3=CC=CC=C3N2

DOS

IR

Vibrations