[Open access]

[Contents scheme]

Acta Cryst. (2014). E70, o560
[ doi:10.1107/S1600536814007879 ]

5-(4-Chloro­phen­oxy)-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde

N. Vinutha, S. M. Kumar, S. Shobhitha, B. Kalluraya, N. K. Lokanath and D. Revannasiddaiah


Key indicators

checkCIF/PLATON results

No syntax errors found




Alert level C THETM01_ALERT_3_C The value of sine(theta_max)/wavelength is less than 0.590 Calculated sin(theta_max)/wavelength = 0.5852 PLAT911_ALERT_3_C Missing # FCF Refl Between THmin & STh/L= 0.585 42 Why ?
Alert level G PLAT005_ALERT_5_G No _iucr_refine_instructions_details in the CIF Please Do ! PLAT380_ALERT_4_G Incorrectly? Oriented X(sp2)-Methyl Moiety ..... C17 Check PLAT431_ALERT_2_G Short Inter HL..A Contact Cl1 .. O2 .. 3.09 Ang. PLAT720_ALERT_4_G Number of Unusual/Non-Standard Labels .......... 3 Note PLAT909_ALERT_3_G Percentage of Observed Data at Theta(Max) still 82 %
0 ALERT level A = Most likely a serious problem - resolve or explain 0 ALERT level B = A potentially serious problem, consider carefully 2 ALERT level C = Check. Ensure it is not caused by an omission or oversight 5 ALERT level G = General information/check it is not something unexpected 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 2 ALERT type 4 Improvement, methodology, query or suggestion 1 ALERT type 5 Informative message, check
checkCIF publication errors
Alert level A PUBL024_ALERT_1_A The number of authors is greater than 5. Please specify the role of each of the co-authors for your paper.
Author Response: ... This work is a collobration between two universities and all the authors have equal scientific contributions to this work. VN -- Solved, refined and analyzed the structure MKS -- Data collection and processing SS -- Performed Synthesis KB -- Designed the synthesis, assisted synthesis and pharmacological studies DR -- Guide and Corresponding author NKL -- Final analysis and manuscript preparation

1 ALERT level A = Data missing that is essential or data in wrong format 0 ALERT level G = General alerts. Data that may be required is missing

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