[Open access]

[Contents scheme]

Acta Cryst. (2013). E69, m89
[ doi:10.1107/S160053681205177X ]

Bis(2,2',2''-nitrilotriacetamide-[kappa]3O,N,O')nickel(II) dinitrate tetrahydrate

X.-H. Deng, Q.-J. Nie and F.-J. Zhu


Key indicators

checkCIF/PLATON results

No syntax errors found




Alert level C PLAT029_ALERT_3_C _diffrn_measured_fraction_theta_full Low ....... 0.978 PLAT244_ALERT_4_C Low 'Solvent' Ueq as Compared to Neighbors of N5 PLAT250_ALERT_2_C Large U3/U1 Ratio for Average U(i,j) Tensor .... 2.1 PLAT911_ALERT_3_C Missing # FCF Refl Between THmin & STh/L= 0.595 54
Alert level G PLAT002_ALERT_2_G Number of Distance or Angle Restraints on AtSite 6 PLAT005_ALERT_5_G No _iucr_refine_instructions_details in the CIF ? PLAT007_ALERT_5_G Note: Number of Unrefined D-H Atoms ............ 6 PLAT154_ALERT_1_G The su's on the Cell Angles are Equal .......... 0.01400 Deg. PLAT710_ALERT_4_G Delete 1-2-3 or 2-3-4 Linear Torsion Angle ... # 3 O1 -NI1 -O1 -C2 18.00 0.00 2.767 1.555 1.555 1.555 PLAT710_ALERT_4_G Delete 1-2-3 or 2-3-4 Linear Torsion Angle ... # 6 O2 -NI1 -O2 -C4 18.00 0.00 2.767 1.555 1.555 1.555 PLAT710_ALERT_4_G Delete 1-2-3 or 2-3-4 Linear Torsion Angle ... # 15 N1 -NI1 -N1 -C5 10.00 0.00 2.767 1.555 1.555 1.555 PLAT710_ALERT_4_G Delete 1-2-3 or 2-3-4 Linear Torsion Angle ... # 20 N1 -NI1 -N1 -C3 2.00 0.00 2.767 1.555 1.555 1.555 PLAT710_ALERT_4_G Delete 1-2-3 or 2-3-4 Linear Torsion Angle ... # 25 N1 -NI1 -N1 -C1 14.00 0.00 2.767 1.555 1.555 1.555 PLAT860_ALERT_3_G Note: Number of Least-Squares Restraints ....... 6 PLAT909_ALERT_3_G Percentage of Observed Data at Theta(Max) still 92 Perc.
0 ALERT level A = Most likely a serious problem - resolve or explain 0 ALERT level B = A potentially serious problem, consider carefully 4 ALERT level C = Check. Ensure it is not caused by an omission or oversight 11 ALERT level G = General information/check it is not something unexpected 1 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 4 ALERT type 3 Indicator that the structure quality may be low 6 ALERT type 4 Improvement, methodology, query or suggestion 2 ALERT type 5 Informative message, check

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