(IUCr) Crystallography Journals Online checkcif report

[Contents scheme]

Acta Cryst. (2003). E59, m707-m709 [ doi:10.1107/S1600536803017008 ]

[4-Amino-N-(pyrimidin-2-yl)benzenesulfonamido-N](triphenylarsine-As)gold(I)

L. L. Marques, E. S. Lang and R. A. Burrow

Online 8 August 2003

Key indicators

Single-crystal X-ray study
T = 173 K
Mean (C-C) = 0.003 Å
R factor = 0.018
wR factor = 0.043
Data-to-parameter ratio = 28.4

checkCIF/PLATON results

No syntax errors found




Alert level B
PLAT028_ALERT_3_B _diffrn_measured_fraction_theta_max  Low .....       0.96         

Alert level C
ABSTM02_ALERT_3_C  The ratio of expected to reported Tmax/Tmin(RR) is > 1.10
            Tmin and Tmax reported:      0.632     1.000
            Tmin and Tmax expected:      0.200     0.350
            RR =      1.107
            Please check that your absorption correction is appropriate.
PLAT062_ALERT_4_C Rescale T(min) & T(max) by ...................       0.35         
PLAT420_ALERT_2_C D-H Without Acceptor       N3     -   H3A               ?         

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      0.350
            Tmax scaled      0.350 Tmin scaled      0.221

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

   0 ALERT type 1 CIF construction/syntax error, inconsistent or missing data
   1 ALERT type 2 Indicator that the structure model may be wrong or deficient
   3 ALERT type 3 Indicator that the structure quality may be low
   1 ALERT type 4 Improvement, methodology, query or suggestion