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[Contents scheme]

Acta Cryst. (2013). E69, m87
[ doi:10.1107/S1600536812052051 ]

catena-Poly[[mu]2-iodido-diiodidobis([mu]3-pyridine-2-thione-[kappa]3S:S:S)([mu]2-pyridine-2-thione-[kappa]2S:S)tricopper(I)]

F. Ke and W. Wu


Key indicators

checkCIF/PLATON results

No syntax errors found




Alert level B PLAT232_ALERT_2_B Hirshfeld Test Diff (M-X) Cu1 -- S1_c .. 15.3 su PLAT232_ALERT_2_B Hirshfeld Test Diff (M-X) Cu2 -- S1_c .. 11.1 su PLAT232_ALERT_2_B Hirshfeld Test Diff (M-X) Cu3 -- S2_a .. 18.2 su
Alert level C PLAT232_ALERT_2_C Hirshfeld Test Diff (M-X) Cu1 -- S1 .. 9.7 su PLAT232_ALERT_2_C Hirshfeld Test Diff (M-X) Cu1 -- S3 .. 5.7 su PLAT232_ALERT_2_C Hirshfeld Test Diff (M-X) Cu2 -- S2 .. 6.5 su PLAT342_ALERT_3_C Low Bond Precision on C-C Bonds ............... 0.0138 Ang PLAT420_ALERT_2_C D-H Without Acceptor N3 - H3 ... ? PLAT911_ALERT_3_C Missing # FCF Refl Between THmin & STh/L= 0.595 82
Alert level G PLAT004_ALERT_5_G Info: Polymeric Structure Found with Dimension . 1 PLAT005_ALERT_5_G No _iucr_refine_instructions_details in the CIF ? PLAT007_ALERT_5_G Note: Number of Unrefined D-H Atoms ............ 3 PLAT232_ALERT_2_G Hirshfeld Test Diff (M-X) I1 -- Cu1 .. 9.7 su PLAT232_ALERT_2_G Hirshfeld Test Diff (M-X) I1 -- Cu2 .. 27.7 su PLAT232_ALERT_2_G Hirshfeld Test Diff (M-X) I3 -- Cu3 .. 7.3 su PLAT764_ALERT_4_G Overcomplete CIF Bond List Detected (Rep/Expd) . 1.18 Ratio PLAT909_ALERT_3_G Percentage of Observed Data at Theta(Max) still 62 Perc.
0 ALERT level A = Most likely a serious problem - resolve or explain 3 ALERT level B = A potentially serious problem, consider carefully 6 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 0 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 10 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 1 ALERT type 4 Improvement, methodology, query or suggestion 3 ALERT type 5 Informative message, check

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