[Open access]

[Contents scheme]

Acta Cryst. (2013). E69, o1736
[ doi:10.1107/S1600536813028766 ]

5-Methyl-1,3-diphenyl-N-(5-phenyl-1,3,4-thia­diazol-2-yl)-1H-pyrazole-4-carboxamide

Chandra, S. S. Mahesh, N. Srikantamurthy, K. B. Umesha, K. Palani and M. Mahendra


Key indicators

checkCIF/PLATON results

No syntax errors found




Alert level C PLAT241_ALERT_2_C High Ueq as Compared to Neighbors for ..... C40B Check PLAT340_ALERT_3_C Low Bond Precision on C-C Bonds ............... 0.0041 Ang. PLAT906_ALERT_3_C Large K value in the Analysis of Variance ...... 3.377 Check PLAT911_ALERT_3_C Missing # FCF Refl Between THmin & STh/L= 0.595 44
Alert level G PLAT005_ALERT_5_G No _iucr_refine_instructions_details in the CIF Please Do ! PLAT007_ALERT_5_G Number of Unrefined Donor-H Atoms .............. 2 Why ? PLAT154_ALERT_1_G The su's on the Cell Angles are Equal .......... 0.00200 Deg. PLAT199_ALERT_1_G Reported _cell_measurement_temperature ..... (K) 273 Check PLAT200_ALERT_1_G Reported _diffrn_ambient_temperature ..... (K) 273 Check PLAT909_ALERT_3_G Percentage of Observed Data at Theta(Max) still 43 % PLAT910_ALERT_3_G Missing # of FCF Reflections Below Th(Min) ..... 1 Why ?
0 ALERT level A = Most likely a serious problem - resolve or explain 0 ALERT level B = A potentially serious problem, consider carefully 4 ALERT level C = Check. Ensure it is not caused by an omission or oversight 7 ALERT level G = General information/check it is not something unexpected 3 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 1 ALERT type 2 Indicator that the structure model may be wrong or deficient 5 ALERT type 3 Indicator that the structure quality may be low 0 ALERT type 4 Improvement, methodology, query or suggestion 2 ALERT type 5 Informative message, check
checkCIF publication errors
Alert level A PUBL024_ALERT_1_A The number of authors is greater than 5. Please specify the role of each of the co-authors for your paper.
Author Response: The role of authors have been given below.
 Chandra -- Solved and analyzed the structre
 Mahesh S S -- Data collection and processing
 Srikantamurthy N -- Synthesis
 Umesha K B -- Crystallization in various conditions
 Palani K -- Biological studies
 Mahendra M -- Guide, Principal investigator and corresponding author



1 ALERT level A = Data missing that is essential or data in wrong format 0 ALERT level G = General alerts. Data that may be required is missing

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