[HTML version][PDF version][Article Abstract][CIF][3d view][Structure Factors][Issue contents]  [Buy article online]

[Contents scheme]

Acta Cryst. (2005). E61, m1481-m1483  [ doi:10.1107/S1600536805021033 ]

(5,5,7,12,12,14-Hexamethyl-1,4,8,11-tetraazacyclotetradecane-1,8-diacetato)nickel(II) tetrahydrate

S.-F. Wang, J.-Y. Xue, L. Shi, H.-L. Zhu and S. W. Ng

Online 6 July 2005

Key indicators

checkCIF/PLATON results

No syntax errors found

Alert level B PLAT417_ALERT_2_B Short Inter D-H..H-D H3W2 .. H4W2 .. 2.04 Ang. PLAT420_ALERT_2_B D-H Without Acceptor O4W - H4W1 ... ?
Alert level C ABSTM02_ALERT_3_C The ratio of expected to reported Tmax/Tmin(RR') is < 0.90 Tmin and Tmax reported: 0.713 0.902 Tmin(prime) and Tmax expected: 0.839 0.900 RR(prime) = 0.847 Please check that your absorption correction is appropriate. PLAT042_ALERT_1_C Calc. and Rep. MoietyFormula Strings Differ .... ? PLAT061_ALERT_3_C Tmax/Tmin Range Test RR' too Large ............. 0.84 PLAT417_ALERT_2_C Short Inter D-H..H-D H3W2 .. H4W1 .. 2.13 Ang. PLAT720_ALERT_4_C Number of Unusual/Non-Standard Label(s) ........ 8
0 ALERT level A = In general: serious problem 2 ALERT level B = Potentially serious problem 5 ALERT level C = Check and explain 0 ALERT level G = General alerts; check 1 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 2 ALERT type 3 Indicator that the structure quality may be low 1 ALERT type 4 Improvement, methodology, query or suggestion

Copyright © International Union of Crystallography
IUCr Webmaster