Geometry & MOs

Info

ID:	23853
PubChem CID:	606795
Reduced:	ClON2S2H7C12 (1)
Stoich.:	ABC2D2E7F12 (1)
Weight, g/mol:	293.968833
ΔH_f, kcal/mol:	38.87
Dipole, Da:	5.26
IP(EA), eV:	-9.08(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N-(1,3-thiazol-2-yl)-1-benzothiophene-2-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=C(S2)C(=O)NC3=NC=CS3)Cl

DOS

IR

Vibrations