[Open access]

[Contents scheme]

Acta Cryst. (2013). E69, o550
[ doi:10.1107/S1600536813006880 ]

4-(6-Benzyl-7-oxo-1,2,3,4,5,5a,5a1,6,7,7a,8,12b-dodecahydrobenzo[f]cycloocta[cd]isoindol-8-yl)benzonitrile

Y.-L. Zhang and Y.-M. Hu


Key indicators

checkCIF/PLATON results

No syntax errors found




Alert level C PLAT230_ALERT_2_C Hirshfeld Test Diff for N1 -- C17 .. 5.1 su PLAT230_ALERT_2_C Hirshfeld Test Diff for C28 -- C31 .. 5.8 su
Alert level G PLAT005_ALERT_5_G No _iucr_refine_instructions_details in the CIF ? PLAT371_ALERT_2_G Long C(sp2)-C(sp1) Bond C28 - C31 ... 1.43 Ang. PLAT793_ALERT_4_G The Model has Chirality at C8 (Verify) .... S PLAT793_ALERT_4_G The Model has Chirality at C14 (Verify) .... S PLAT793_ALERT_4_G The Model has Chirality at C15 (Verify) .... R PLAT793_ALERT_4_G The Model has Chirality at C16 (Verify) .... S PLAT793_ALERT_4_G The Model has Chirality at C18 (Verify) .... R PLAT912_ALERT_4_G Missing # of FCF Reflections Above STh/L= 0.600 20
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 8 ALERT level G = General information/check it is not something unexpected 0 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 0 ALERT type 3 Indicator that the structure quality may be low 6 ALERT type 4 Improvement, methodology, query or suggestion 1 ALERT type 5 Informative message, check

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