(IUCr) Crystallography Journals Online checkcif report

[Contents scheme]

Acta Cryst. (2003). E59, o480-o482 [ doi:10.1107/S1600536803004859 ]

n-Undecylammonium bromide monohydrate

G. J. Kruger, M. Rademeyer and D. G. Billing

Online 21 March 2003

Key indicators

Single-crystal X-ray study
T = 293 K
Mean (C-C) = 0.006 Å
R factor = 0.044
wR factor = 0.123
Data-to-parameter ratio = 28.7

checkCIF results

No syntax errors found

ADDSYM reports no extra symmetry

General Notes



FORMU_01  There is a discrepancy between the atom counts in the                 
          _chemical_formula_sum and _chemical_formula_moiety. This is           
          usually due to the moiety formula being in the wrong format.          
          Atom count from _chemical_formula_sum:   C11 H28 Br1 N1 O1            
          Atom count from _chemical_formula_moiety: