(IUCr) Crystallography Journals Online checkcif report

Acta Cryst. (2006). E62, i147-i149 [ doi:10.1107/S1600536806022665 ]

Samarium(III) carbonate hydroxide

Y. Xu, S.-H. Ding, W.-J. Feng, G.-P. Zhou and Y.-G. Liu

Online 21 June 2006

Key indicators

Single-crystal X-ray study
T = 293 K
Mean (O-C) = 0.007 Å
R factor = 0.047
wR factor = 0.122
Data-to-parameter ratio = 10.3

checkCIF/PLATON results

No syntax errors found




Alert level C
PLAT062_ALERT_4_C Rescale T(min) & T(max) by .....................       0.85       
PLAT199_ALERT_1_C Check the Reported _cell_measurement_temperature        293 K     
PLAT200_ALERT_1_C Check the Reported _diffrn_ambient_temperature .        293 K     
PLAT764_ALERT_4_C Overcomplete CIF Bond List Detected (Rep/Expd) .       1.75 Ratio 

Alert level G
ABSTM02_ALERT_3_G  When printed, the submitted absorption T values will be
            replaced by the scaled T values. Since the ratio of scaled T's
            is identical to the ratio of reported T values, the scaling
            does not imply a change to the absorption corrections used in
            the study.
            Ratio of Tmax expected/reported      0.853
            Tmax scaled      0.378 Tmin scaled      0.331

   0 ALERT level A = In general: serious problem
   0 ALERT level B = Potentially serious problem
   4 ALERT level C = Check and explain
   1 ALERT level G = General alerts; check

   2 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
   1 ALERT type 3 Indicator that the structure quality may be low
   2 ALERT type 4 Improvement, methodology, query or suggestion