CHOICE |
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9. DATA REQUEST (for): | |
CELL ONLY | ONLY the cell parameters will be determined. Useful if you are checking a compound whose structure has already been solved. Complete Special Request if you need any other data. |
IDENTITY | ONLY Partial X-Ray Data will be collected (usually upto 20°). NO DATA WILL BE SAVED. By Default, Structure will be solved for FREE, the Molecular Structure will be analyzed to see if it is dimer/oligomer/poylmer and only an ORTEP Figure will be given to you. Complete Special Request if you need any other data. |
Publication | X-Ray Data will be collected upto 25°. The data will be saved. |
Publ. in ACTA | X-Ray Data will be collected upto 27.5°. The data will be saved. |
10. STRUCTURE SOLUTION: | |
No | ONLY the X-Ray Intensity data will be given. NO molecular Structure Determination will be done. By Default the data will be in the standard .CIF format (or SHELX's .HKL format, if requested in Special Request Section). | Do With Requester | ONLY for those interested in learning to Solve and Refine Structures WITH the crystallographer. Structure Determination from the X-ray Data will be done and the initial structure/model will be refined to completion. ALL the work (excluding Data Collection) will be done only in the presence of the requester. We will get an ORTEP Figure, SHELX's .INS, .HKL, .LST, .CIF files. We will study the Molecular Structure to see if it is dimer/oligomer/poylmer. | Yes | Structure Determination from the X-ray Data will be done and the initial structure/model will be refined to completion. An ORTEP Figure, SHELX's .INS, .HKL, .LST, .CIF files will be given to you. Complete Special Request if you need any other data. The Molecular Structure will be analyzed to see if it is dimer/oligomer/poylmer. |
11. Special Request? |
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Post-Refinement Analyses:
Post-Refinement Analyses will be limited to see if the Molecule is dimer/oligomer/poylmer,
when requested for: