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Acta Cryst. (2005). E61, m1652-m1654  [ doi:10.1107/S1600536805023536 ]

Bis{bis[2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-triene]potassium(I)} bis(2-thioxo-4,5-dihydro-1,3-dithiole-4,5-dithiolato)zinc(II)

J. Liu, J.-H. Zhang, D.-Q. Wang and J.-M. Dou

Online 30 July 2005


Key indicators

checkCIF/PLATON results

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Alert level B PLAT026_ALERT_3_B Ratio Observed / Unique Reflections too Low .... 37 Perc. PLAT230_ALERT_2_B Hirshfeld Test Diff for S7 - C60 .. 7.36 su
Alert level C PLAT042_ALERT_1_C Calc. and Rep. MoietyFormula Strings Differ .... ? PLAT230_ALERT_2_C Hirshfeld Test Diff for O14 - C39 .. 5.30 su PLAT230_ALERT_2_C Hirshfeld Test Diff for O15 - C40 .. 5.89 su PLAT230_ALERT_2_C Hirshfeld Test Diff for S8 - C60 .. 6.43 su PLAT241_ALERT_2_C Check High Ueq as Compared to Neighbors for C4 PLAT241_ALERT_2_C Check High Ueq as Compared to Neighbors for C18 PLAT241_ALERT_2_C Check High Ueq as Compared to Neighbors for C39 PLAT241_ALERT_2_C Check High Ueq as Compared to Neighbors for C54 PLAT241_ALERT_2_C Check High Ueq as Compared to Neighbors for S1 PLAT241_ALERT_2_C Check High Ueq as Compared to Neighbors for S2 PLAT241_ALERT_2_C Check High Ueq as Compared to Neighbors for S4 PLAT241_ALERT_2_C Check High Ueq as Compared to Neighbors for S6 PLAT241_ALERT_2_C Check High Ueq as Compared to Neighbors for S7 PLAT241_ALERT_2_C Check High Ueq as Compared to Neighbors for S10 PLAT242_ALERT_2_C Check Low Ueq as Compared to Neighbors for K1 PLAT242_ALERT_2_C Check Low Ueq as Compared to Neighbors for K2 PLAT242_ALERT_2_C Check Low Ueq as Compared to Neighbors for C57 PLAT242_ALERT_2_C Check Low Ueq as Compared to Neighbors for C58 PLAT242_ALERT_2_C Check Low Ueq as Compared to Neighbors for C60 PLAT341_ALERT_3_C Low Bond Precision on C-C bonds (x 1000) Ang ... 9 PLAT360_ALERT_2_C Short C(sp3)-C(sp3) Bond C39 - C40 ... 1.39 Ang. PLAT480_ALERT_4_C Long H...A H-Bond Reported H30 .. S2 .. 2.93 Ang. PLAT480_ALERT_4_C Long H...A H-Bond Reported H21B .. S1 .. 2.93 Ang. PLAT480_ALERT_4_C Long H...A H-Bond Reported H13B .. S5 .. 2.99 Ang. PLAT480_ALERT_4_C Long H...A H-Bond Reported H33 .. S3 .. 2.90 Ang. PLAT480_ALERT_4_C Long H...A H-Bond Reported H3 .. S2 .. 2.93 Ang. PLAT480_ALERT_4_C Long H...A H-Bond Reported H35A .. S8 .. 2.95 Ang. PLAT480_ALERT_4_C Long H...A H-Bond Reported H49B .. S10 .. 2.92 Ang. PLAT480_ALERT_4_C Long H...A H-Bond Reported H24A .. S9 .. 2.96 Ang. PLAT480_ALERT_4_C Long H...A H-Bond Reported H7A .. S9 .. 2.97 Ang. PLAT701_ALERT_1_C Bond Calc 3.507(2), Rep 3.5034(19), Dev.. 1.80 Sigma S3 -S8 1.555 1.445
0 ALERT level A = In general: serious problem 2 ALERT level B = Potentially serious problem 31 ALERT level C = Check and explain 0 ALERT level G = General alerts; check 2 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 20 ALERT type 2 Indicator that the structure model may be wrong or deficient 2 ALERT type 3 Indicator that the structure quality may be low 9 ALERT type 4 Improvement, methodology, query or suggestion

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