[Open access]

[Contents scheme]

Acta Cryst. (2012). E68, m1450
[ doi:10.1107/S1600536812041360 ]

1,1'-Bis[bis(4-tert-butylphenyl)methyl]ferrocene

H. Bauer, Y. Sun and H. Sitzmann


Key indicators

checkCIF/PLATON results

No syntax errors found




Alert level C THETM01_ALERT_3_C The value of sine(theta_max)/wavelength is less than 0.590 Calculated sin(theta_max)/wavelength = 0.5761 PLAT023_ALERT_3_C Resolution (too) Low [sin(theta)/Lambda < 0.6].. 62.66 Deg. PLAT911_ALERT_3_C Missing # FCF Refl Between THmin & STh/L= 0.576 11
Alert level G PLAT005_ALERT_5_G No _iucr_refine_instructions_details in CIF .... ? PLAT128_ALERT_4_G Alternate Setting of Space-group P21/c ....... P21/n PLAT909_ALERT_3_G Percentage of Observed Data at Theta(Max) still 75 Perc.
0 ALERT level A = Most likely a serious problem - resolve or explain 0 ALERT level B = A potentially serious problem, consider carefully 3 ALERT level C = Check. Ensure it is not caused by an omission or oversight 3 ALERT level G = General information/check it is not something unexpected 0 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 0 ALERT type 2 Indicator that the structure model may be wrong or deficient 4 ALERT type 3 Indicator that the structure quality may be low 1 ALERT type 4 Improvement, methodology, query or suggestion 1 ALERT type 5 Informative message, check

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