Geometry & MOs

Info

ID:	295684
PubChem CID:	117542358
Reduced:	BrNOSH12C15 (1)
Stoich.:	ABCDE12F15 (1)
Weight, g/mol:	262.023455
ΔH_f, kcal/mol:	12.22
Dipole, Da:	3.89
IP(EA), eV:	-8.79(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-amino-2-thiophen-2-yl-4H-1,4-benzothiazin-3-one

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2SC(C1=O)C3=CC(=CC=C3)Br

DOS

IR

Vibrations