Acta Cryst. (2006). E62, m2826-m2829  [ doi:10.1107/S1600536806040086 ]

Bis(2,2'-bipyridine-²N,N')(oxalato-²O,O')zinc(II) pentahydrate

M. Sestan Juric, P. Planinic and G. Giester

Online 7 October 2006

Key indicators

• Single-crystal X-ray study
• T = 200 K
• Mean (C-C) = 0.003 Å
• R factor = 0.034
• wR factor = 0.093
• Data-to-parameter ratio = 20.1

checkCIF/PLATON results

No syntax errors found




Alert level C
PLAT152_ALERT_1_C Supplied and Calc Volume s.u. Inconsistent .....          ?
PLAT369_ALERT_2_C Long   C(sp2)-C(sp2) Bond  C15    -   C16    ...       1.53 Ang. 
PLAT410_ALERT_2_C Short Intra H...H Contact  H24    ..  H27     ..       1.92 Ang. 
PLAT417_ALERT_2_C Short Inter D-H..H-D       H72    ..  H91     ..       2.11 Ang. 

Alert level G
REFLT03_ALERT_1_G ALERT: Expected hkl max differ from CIF values
           From the CIF: _diffrn_reflns_theta_max           33.37
           From the CIF: _reflns_number_total               7328
           From the CIF: _diffrn_reflns_limit_ max hkl   15.   32.   14.
           From the CIF: _diffrn_reflns_limit_ min hkl  -15.  -32.  -14.
           TEST1: Expected hkl limits for theta max
           Calculated maximum hkl   15.   35.   16.
           Calculated minimum hkl  -15.  -35.  -16.

   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
   3 ALERT type 2 Indicator that the structure model may be wrong or deficient
   0 ALERT type 3 Indicator that the structure quality may be low
   0 ALERT type 4 Improvement, methodology, query or suggestion
   0 ALERT type 5 Informative message, check

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