[Open access]

[Contents scheme]

Acta Cryst. (2013). E69, m689
[ doi:10.1107/S1600536813032121 ]

[mu]-Hexa­thio­metadiphosphato-bis­[(1,4,7,10,13,16-hexa­oxa­cyclo­octa­decane-[kappa]6O)rubidium] aceto­nitrile disolvate

M. Gjikaj, N.-P. Pook and F. Qarri


Key indicators

checkCIF/PLATON results

No syntax errors found




Alert level C PLAT127_ALERT_1_C Implicit Hall Symbol Inconsistent with Explicit -P 2yn PLAT244_ALERT_4_C Low 'Solvent' Ueq as Compared to Neighbors of C14 Check PLAT341_ALERT_3_C Low Bond Precision on C-C Bonds ............... 0.0071 Ang. PLAT790_ALERT_4_C Centre of Gravity not Within Unit Cell: Resd. # 1 C12 H24 O6 PLAT906_ALERT_3_C Large K value in the Analysis of Variance ...... 6.318 Check
Alert level G PLAT005_ALERT_5_G No _iucr_refine_instructions_details in the CIF Please Do ! PLAT042_ALERT_1_G Calc. and Reported MoietyFormula Strings Differ Please Check PLAT045_ALERT_1_G Calculated and Reported Z Differ by ............ 2.00 Ratio PLAT164_ALERT_4_G Nr. of Refined C-H H-Atoms in Heavy-Atom Struct. 27 PLAT764_ALERT_4_G Overcomplete CIF Bond List Detected (Rep/Expd) . 1.38 Ratio PLAT790_ALERT_4_G Centre of Gravity not Within Unit Cell: Resd. # 2 P2 S6 PLAT790_ALERT_4_G Centre of Gravity not Within Unit Cell: Resd. # 3 C2 H3 N PLAT790_ALERT_4_G Centre of Gravity not Within Unit Cell: Resd. # 4 Rb 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 5 ALERT level C = Check. Ensure it is not caused by an omission or oversight 9 ALERT level G = General information/check it is not something unexpected 3 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 0 ALERT type 2 Indicator that the structure model may be wrong or deficient 3 ALERT type 3 Indicator that the structure quality may be low 7 ALERT type 4 Improvement, methodology, query or suggestion 1 ALERT type 5 Informative message, check

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