[HTML version][PDF version][Article Abstract][CIF][3d view][Structure Factors][Supplementary Material][Issue contents]  [Open access]

[Contents scheme]

Acta Cryst. (2013). E69, o1208-o1209  [ doi:10.1107/S1600536813017704 ]

5''-(4-Nitrobenzylidene)-7'-(4-nitrophenyl)-1''-methyl-1',3',5',6',7',7a'-hexahydrodispiro[acenaphthylene-1,5'-pyrrolo[1,2-c][1,3]thiazole-6',3''-piperidine]-2,4''(1H)-dione including an unknown solvate

R. Vishnupriya, J. Suresh, S. Sivakumar, R. R. Kumar and P. L. N. Lakshman


Key indicators

checkCIF/PLATON results

No syntax errors found




Alert level C PLAT230_ALERT_2_C Hirshfeld Test Diff for O4B -- C12B .. 5.4 su PLAT230_ALERT_2_C Hirshfeld Test Diff for C11B -- C12B .. 5.4 su PLAT242_ALERT_2_C Check Low Ueq as Compared to Neighbors for N2A PLAT242_ALERT_2_C Check Low Ueq as Compared to Neighbors for N2B PLAT334_ALERT_2_C Small Average Benzene C-C Dist. C71A -C76A 1.37 Ang. PLAT334_ALERT_2_C Small Average Benzene C-C Dist. C71B -C76B 1.37 Ang. PLAT906_ALERT_3_C Large K value in the Analysis of Variance ...... 14.284 PLAT906_ALERT_3_C Large K value in the Analysis of Variance ...... 2.871 PLAT910_ALERT_3_C Missing # of FCF Reflections Below Th(Min) ..... 1 PLAT911_ALERT_3_C Missing # FCF Refl Between THmin & STh/L= 0.600 49 PLAT913_ALERT_3_C Missing # of Very Strong Reflections in FCF .... 1 PLAT918_ALERT_3_C Reflection(s) # with I(obs) much smaller I(calc) 3
Alert level G PLAT005_ALERT_5_G No _iucr_refine_instructions_details in the CIF ? Do ! PLAT199_ALERT_1_G Check the Reported _cell_measurement_temperature 293 K PLAT200_ALERT_1_G Check the Reported _diffrn_ambient_temperature 293 K PLAT606_ALERT_4_G VERY LARGE Solvent Accessible VOID(S) in Structure ! Info PLAT720_ALERT_4_G Number of Unusual/Non-Standard Labels .......... 18 PLAT793_ALERT_4_G The Model has Chirality at C5A (Verify) .... R PLAT793_ALERT_4_G The Model has Chirality at C5B (Verify) .... S PLAT793_ALERT_4_G The Model has Chirality at C7A (Verify) .... S PLAT793_ALERT_4_G The Model has Chirality at C7B (Verify) .... R PLAT793_ALERT_4_G The Model has Chirality at C8A (Verify) .... S PLAT793_ALERT_4_G The Model has Chirality at C8B (Verify) .... R PLAT793_ALERT_4_G The Model has Chirality at C11A (Verify) .... S PLAT793_ALERT_4_G The Model has Chirality at C11B (Verify) .... R PLAT869_ALERT_4_G ALERTS Related to the use of SQUEEZE Suppressed ! Info PLAT912_ALERT_4_G Missing # of FCF Reflections Above STh/L= 0.600 36 PLAT961_ALERT_5_G Dataset Contains no Negative Intensities ....... ! Check
0 ALERT level A = Most likely a serious problem - resolve or explain 0 ALERT level B = A potentially serious problem, consider carefully 12 ALERT level C = Check. Ensure it is not caused by an omission or oversight 16 ALERT level G = General information/check it is not something unexpected 2 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 6 ALERT type 2 Indicator that the structure model may be wrong or deficient 6 ALERT type 3 Indicator that the structure quality may be low 12 ALERT type 4 Improvement, methodology, query or suggestion 2 ALERT type 5 Informative message, check

Copyright © International Union of Crystallography
IUCr Webmaster