Calculate MW based on the Molecule Formula throw the error

Hi,

 

We have using the .NET API Application. Using the ElementalAnalyser to calculate the MW based on MF,

 

When Try Use this formula BrH.0.5(H2O) Then Throwing the Error.Seems like decimal “0.5(H2O)” Formula is not accepting

 

If Formula BrH.(H2O) and BrH.2(H2O) is working fine.

 

Please find sample code below.

 

ElementalAnalyser ws = new ElementalAnalyser();

 

ws.setMolecule("BrH.0.5(H2O)”);

 

double Mass1 = ws.mass();

 

Please provide the solution for this or any other approach is available

Regards
Siva

Hi Siva,

We don't support fractional numbers in Elemental Analysis calculation. We're considering supporting them.

Regards,

Peter

Hi,

Let me know when will get resolved this issue. this is critical issue for us.

Regards

Siva  

Hi, 

We will try to implement this in 2014.

BRs,

Peter