[Open access]

[Contents scheme]

Acta Cryst. (2013). E69, m530-m531
[ doi:10.1107/S1600536813021880 ]

(2,3,5,6-Tetrafluorophenolato)[5,10,15,20-tetrakis(4-methoxyphenyl)porphyrinato]iron(III) cyclohexane monosolvate

N. Xu, D. R. Powell and G. B. Richter-Addo


Key indicators

checkCIF/PLATON results

No syntax errors found



Alert level A DIFF019_ALERT_1_A _diffrn_standards_number is missing Number of standards used in measurement. DIFF020_ALERT_1_A _diffrn_standards_interval_count and _diffrn_standards_interval_time are missing. Number of measurements between standards or time (min) between standards. DIFF022_ALERT_1_A _diffrn_standards_decay_% is missing Percentage decrease in standards intensity.
Alert level C PLAT220_ALERT_2_C Large Non-Solvent C Ueq(max)/Ueq(min) ... 3.1 Ratio PLAT243_ALERT_4_C High 'Solvent' Ueq as Compared to Neighbors of C3S PLAT243_ALERT_4_C High 'Solvent' Ueq as Compared to Neighbors of C6S PLAT244_ALERT_4_C Low 'Solvent' Ueq as Compared to Neighbors of C1S PLAT244_ALERT_4_C Low 'Solvent' Ueq as Compared to Neighbors of C4S PLAT411_ALERT_2_C Short Inter H...H Contact H1S2 .. H5S2 .. 2.05 Ang. PLAT731_ALERT_1_C Bond Calc 1.519(12), Rep 1.519(5) ...... 2 su-Ra C2S -C3S 1.555 1.555 # 122 PLAT731_ALERT_1_C Bond Calc 1.504(13), Rep 1.504(5) ...... 3 su-Ra C5S -C6S 1.555 1.555 # 131 PLAT906_ALERT_3_C Large K value in the Analysis of Variance ...... 2.524 PLAT910_ALERT_3_C Missing # of FCF Reflections Below Th(Min) ..... 3
Alert level G PLAT005_ALERT_5_G No _iucr_refine_instructions_details in the CIF ? Do ! PLAT720_ALERT_4_G Number of Unusual/Non-Standard Labels .......... 12 PLAT860_ALERT_3_G Note: Number of Least-Squares Restraints ....... 69 PLAT912_ALERT_4_G Missing # of FCF Reflections Above STh/L= 0.600 146
3 ALERT level A = Most likely a serious problem - resolve or explain 0 ALERT level B = A potentially serious problem, consider carefully 10 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 5 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 2 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 6 ALERT type 4 Improvement, methodology, query or suggestion 1 ALERT type 5 Informative message, check

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