[Open access]

[Contents scheme]

Acta Cryst. (2013). E69, o218
[ doi:10.1107/S1600536812051343 ]

(7aR)-1-[(2R,5S,E)-6-Hydroxy-5,6-dimethylhept-3-en-2-yl]-7a-methylhexahydro-1H-inden-4(2H)-one

M. L. Rivadulla, M. Sene, M. González and B. Covelo


Key indicators

checkCIF/PLATON results

No syntax errors found




Alert level C PLAT220_ALERT_2_C Large Non-Solvent C Ueq(max)/Ueq(min) ... 3.1 Ratio PLAT242_ALERT_2_C Check Low Ueq as Compared to Neighbors for C5' PLAT242_ALERT_2_C Check Low Ueq as Compared to Neighbors for C7' PLAT250_ALERT_2_C Large U3/U1 Ratio for Average U(i,j) Tensor .... 2.1 PLAT905_ALERT_3_C Negative K value in the Analysis of Variance ... -0.440
Alert level G PLAT005_ALERT_5_G No _iucr_refine_instructions_details in the CIF ? PLAT007_ALERT_5_G Note: Number of Unrefined D-H Atoms ............ 1 PLAT199_ALERT_1_G Check the Reported _cell_measurement_temperature 293 K PLAT200_ALERT_1_G Check the Reported _diffrn_ambient_temperature 293 K PLAT720_ALERT_4_G Number of Unusual/Non-Standard Labels .......... 13 PLAT791_ALERT_4_G Note: The Model has Chirality at C1 (Verify) R PLAT791_ALERT_4_G Note: The Model has Chirality at C2' (Verify) R PLAT791_ALERT_4_G Note: The Model has Chirality at C3A (Verify) R PLAT791_ALERT_4_G Note: The Model has Chirality at C5' (Verify) S PLAT791_ALERT_4_G Note: The Model has Chirality at C7A (Verify) R PLAT909_ALERT_3_G Percentage of Observed Data at Theta(Max) still 34 Perc.
0 ALERT level A = Most likely a serious problem - resolve or explain 0 ALERT level B = A potentially serious problem, consider carefully 5 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 2 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 4 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 6 ALERT type 4 Improvement, methodology, query or suggestion 2 ALERT type 5 Informative message, check

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