[Open access]

[Contents scheme]

Acta Cryst. (2013). E69, m330
[ doi:10.1107/S160053681301307X ]

Bis(1,4-diazoniabicyclo[2.2.2]octane) di-[mu]-chlorido-bis[tetrachloridoantimonate(III)] dihydrate

T. Ben Rhaiem, H. Boughzala and A. Driss

Key indicators

checkCIF/PLATON results

No syntax errors found

Alert level B PLAT306_ALERT_2_B Isolated Oxygen Atom (H-atoms Missing ?) ....... O
Alert level C PLAT041_ALERT_1_C Calc. and Reported SumFormula Strings Differ ? PLAT068_ALERT_1_C Reported F000 Differs from Calcd (or Missing)... ? PLAT242_ALERT_2_C Check Low Ueq as Compared to Neighbors for Sb PLAT910_ALERT_3_C Missing # of FCF Reflections Below Th(Min) ..... 1
Alert level G FORMU01_ALERT_2_G There is a discrepancy between the atom counts in the _chemical_formula_sum and the formula from the _atom_site* data. Atom count from _chemical_formula_sum:C12 H32 Cl10 N4 O2 Sb2 Atom count from the _atom_site data: C12 H28 Cl10 N4 O2 Sb2 CELLZ01_ALERT_1_G Difference between formula and atom_site contents detected. CELLZ01_ALERT_1_G WARNING: H atoms missing from atom site list. Is this intentional? From the CIF: _cell_formula_units_Z 2 From the CIF: _chemical_formula_sum C12 H32 Cl10 N4 O2 Sb2 TEST: Compare cell contents of formula and atom_site data atom Z*formula cif sites diff C 24.00 24.00 0.00 H 64.00 56.00 8.00 Cl 20.00 20.00 0.00 N 8.00 8.00 0.00 O 4.00 4.00 0.00 Sb 4.00 4.00 0.00 PLAT005_ALERT_5_G No _iucr_refine_instructions_details in the CIF ? PLAT007_ALERT_5_G Note: Number of Unrefined Donor-H Atoms ........ 2 PLAT042_ALERT_1_G Calc. and Reported MoietyFormula Strings Differ ? PLAT045_ALERT_1_G Calculated and Reported Z Differ by ............ 2.00 Ratio PLAT764_ALERT_4_G Overcomplete CIF Bond List Detected (Rep/Expd) . 1.18 Ratio
0 ALERT level A = Most likely a serious problem - resolve or explain 1 ALERT level B = A potentially serious problem, consider carefully 4 ALERT level C = Check. Ensure it is not caused by an omission or oversight 8 ALERT level G = General information/check it is not something unexpected 6 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 3 ALERT type 2 Indicator that the structure model may be wrong or deficient 1 ALERT type 3 Indicator that the structure quality may be low 1 ALERT type 4 Improvement, methodology, query or suggestion 2 ALERT type 5 Informative message, check

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