Geometry & MOs

Info

ID:	70018
PubChem CID:	47206806
Reduced:	ClNS2O3C9H12 (1)
Stoich.:	ABC2D3E9F12 (1)
Weight, g/mol:	301.985356
ΔH_f, kcal/mol:	-110.43
Dipole, Da:	5.73
IP(EA), eV:	-9.24(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-thiophen-2-yl-1,3-thiazol-4-yl)methylsulfonyl]acetamide

Drug info:

PubChemData

Smile

CC(C(=O)NC)S(=O)(=O)CC1=CC=C(S1)Cl

DOS

IR

Vibrations