[Open access]

[Contents scheme]

Acta Cryst. (2013). E69, m528-m529
[ doi:10.1107/S1600536813023040 ]

{2-[1-(2-Methoxy-6-oxidophenyl-[kappa]O6)ethylidene]-N-methylhydrazinecarbothioamidato-[kappa]2N2,S}(triphenylphosphane-[kappa]P)palladium(II) ethanol monosolvate

B. J. Anderson, K. A. O'Rourke, A. M. Keeler and J. P. Jasinski

Key indicators

checkCIF/PLATON results

No syntax errors found

Alert level B Crystal system given = triclinic PLAT415_ALERT_2_B Short Inter D-H..H-X H1E .. H2EA .. 2.04 Ang.
Alert level C PLAT094_ALERT_2_C Ratio of Maximum / Minimum Residual Density .... 2.02 PLAT244_ALERT_4_C Low 'Solvent' Ueq as Compared to Neighbors of C1E PLAT360_ALERT_2_C Short C(sp3)-C(sp3) Bond C1E - C2E ... 1.34 Ang. PLAT420_ALERT_2_C D-H Without Acceptor N3 - H3 ... ? Check PLAT480_ALERT_4_C Long H...A H-Bond Reported H9C .. O2 .. 2.69 Ang. PLAT910_ALERT_3_C Missing # of FCF Reflections Below Th(Min) ..... 8 PLAT911_ALERT_3_C Missing # FCF Refl Between THmin & STh/L= 0.600 3 PLAT973_ALERT_2_C Large Calcd. Positive Residual Density on Pd1 1.23 eA-3
Alert level G PLAT005_ALERT_5_G No _iucr_refine_instructions_details in the CIF ? Do ! PLAT007_ALERT_5_G Note: Number of Unrefined Donor-H Atoms ........ 2 PLAT720_ALERT_4_G Number of Unusual/Non-Standard Labels .......... 5 PLAT912_ALERT_4_G Missing # of FCF Reflections Above STh/L= 0.600 1125
0 ALERT level A = Most likely a serious problem - resolve or explain 1 ALERT level B = A potentially serious problem, consider carefully 8 ALERT level C = Check. Ensure it is not caused by an omission or oversight 4 ALERT level G = General information/check it is not something unexpected 0 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 2 ALERT type 3 Indicator that the structure quality may be low 4 ALERT type 4 Improvement, methodology, query or suggestion 2 ALERT type 5 Informative message, check

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