[Open access]

[Contents scheme]

Acta Cryst. (2012). E68, m1319
[ doi:10.1107/S160053681204069X ]

Bis(chlorido)(dimethylsulfoxide-[kappa]O)barium(II)

F. Gschwind and M. Jansen


Key indicators

checkCIF/PLATON results

No syntax errors found




Alert level B PLAT201_ALERT_2_B Isotropic non-H Atoms in Main Residue(s) ....... 2 PLAT774_ALERT_1_B Suspect X-Y Bond in CIF: BA1 -- BA1 .. 4.31 Ang. PLAT774_ALERT_1_B Suspect X-Y Bond in CIF: BA1 -- BA1 .. 4.62 Ang. PLAT774_ALERT_1_B Suspect X-Y Bond in CIF: BA1 -- BA1 .. 4.62 Ang. PLAT774_ALERT_1_B Suspect X-Y Bond in CIF: BA1 -- BA1 .. 4.78 Ang.
Alert level C PLAT431_ALERT_2_C Short Inter HL..A Contact Cl1 .. S1 . 3.43 Ang. PLAT431_ALERT_2_C Short Inter HL..A Contact Cl1 .. S1 . 3.43 Ang. PLAT431_ALERT_2_C Short Inter HL..A Contact Cl2 .. S1 . 3.29 Ang. PLAT906_ALERT_3_C Large K value in the Analysis of Variance ...... 2.495 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 4 PLAT913_ALERT_3_C Missing # of Very Strong Reflections in FCF .... 1
Alert level G PLAT005_ALERT_5_G No _iucr_refine_instructions_details in CIF .... ? PLAT083_ALERT_2_G SHELXL Second Parameter in WGHT Unusually Large. 30.08 PLAT152_ALERT_1_G The Supplied and Calc. Volume s.u. Differ by ... 3 Units PLAT764_ALERT_4_G Overcomplete CIF Bond List Detected (Rep/Expd) . 2.36 Ratio PLAT804_ALERT_5_G ARU-Pack Problem in PLATON Analysis ............ 1 Times PLAT912_ALERT_4_G Missing # of FCF Reflections Above STh/L= 0.600 2
0 ALERT level A = Most likely a serious problem - resolve or explain 5 ALERT level B = A potentially serious problem, consider carefully 7 ALERT level C = Check. Ensure it is not caused by an omission or oversight 6 ALERT level G = General information/check it is not something unexpected 5 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 5 ALERT type 2 Indicator that the structure model may be wrong or deficient 4 ALERT type 3 Indicator that the structure quality may be low 2 ALERT type 4 Improvement, methodology, query or suggestion 2 ALERT type 5 Informative message, check

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