Geometry & MOs

Info

ID:	139825
PubChem CID:	52602721
Reduced:	NSO4C12H17 (1)
Stoich.:	ABC4D12E17 (1)
Weight, g/mol:	420.061378
ΔH_f, kcal/mol:	-149.06
Dipole, Da:	1.69
IP(EA), eV:	-8.86(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[2-[(4-fluorophenoxy)methyl]-1,3-thiazol-4-yl]methylsulfonylmethyl]benzamide

Drug info:

PubChemData

Smile

CN(C)C(=O)CS(=O)(=O)CC1=CC=CC=C1OC

DOS

IR

Vibrations