Geometry & MOs

Info

ID:	387592
PubChem CID:	134986032
Reduced:	OSC5H9 (2)
Stoich.:	ABC5D9 (2)
Weight, g/mol:	238.035912
ΔH_f, kcal/mol:	-94.08
Dipole, Da:	4.22
IP(EA), eV:	-8.35(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-benzothiazol-3-ium-2-amine;tetrafluoroborate

Drug info:

PubChemData

Smile

CC(C)SC1(CCCCC1=O)S(=O)C

DOS

IR

Vibrations