Geometry & MOs

Info

ID:	70021
PubChem CID:	47206847
Reduced:	NO2S2C14H17 (1)
Stoich.:	AB2C2D14E17 (1)
Weight, g/mol:	297.049336
ΔH_f, kcal/mol:	-50.92
Dipole, Da:	7.39
IP(EA), eV:	-9.22(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(ethylsulfonylmethyl)-2-(2-methoxyphenyl)-1,3-thiazole

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)C2=NC(=CS2)CS(=O)(=O)C

DOS

IR

Vibrations