Geometry & MOs

Info

ID:	30842
PubChem CID:	841996
Reduced:	SN3O3C14H15 (1)
Stoich.:	AB3C3D14E15 (1)
Weight, g/mol:	335.989089
ΔH_f, kcal/mol:	-15.72
Dipole, Da:	9.63
IP(EA), eV:	-9.07(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,6-dichloro-N-(5-methylpyridin-2-yl)-1-benzothiophene-2-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1OC)C(=O)NC2=NN=C(S2)C3CC3

DOS

IR

Vibrations