[Open access]

[Contents scheme]

Acta Cryst. (2013). E69, o189
[ doi:10.1107/S1600536812051768 ]

2-(2-Hydroxy-2-phenylethyl)-1-methylcyclopropan-1-ol

H. Mao, Y.-W. Tu, S.-K. Li, X.-J. Wang and P.-P. Wang


Key indicators

checkCIF/PLATON results

No syntax errors found




Alert level C PLAT026_ALERT_3_C Ratio Observed / Unique Reflections too Low .... 46 Perc. PLAT029_ALERT_3_C _diffrn_measured_fraction_theta_full Low ....... 0.972 PLAT241_ALERT_2_C Check High Ueq as Compared to Neighbors for C5A PLAT242_ALERT_2_C Check Low Ueq as Compared to Neighbors for C1 PLAT340_ALERT_3_C Low Bond Precision on C-C Bonds ............... 0.0043 Ang PLAT790_ALERT_4_C Centre of Gravity not Within Unit Cell: Resd. # 1 C12 H16 O2 PLAT906_ALERT_3_C Large K value in the Analysis of Variance ...... 10.870 PLAT906_ALERT_3_C Large K value in the Analysis of Variance ...... 3.098 PLAT911_ALERT_3_C Missing # FCF Refl Between THmin & STh/L= 0.600 7
Alert level G PLAT002_ALERT_2_G Number of Distance or Angle Restraints on AtSite 8 PLAT005_ALERT_5_G No _iucr_refine_instructions_details in the CIF ? PLAT007_ALERT_5_G Note: Number of Unrefined D-H Atoms ............ 4 PLAT072_ALERT_2_G SHELXL First Parameter in WGHT Unusually Large. 0.13 PLAT720_ALERT_4_G Number of Unusual/Non-Standard Labels .......... 11 PLAT793_ALERT_4_G The Model has Chirality at C7 (Verify) .... R PLAT793_ALERT_4_G The Model has Chirality at C7A (Verify) .... R PLAT793_ALERT_4_G The Model has Chirality at C9 (Verify) .... S PLAT793_ALERT_4_G The Model has Chirality at C9A (Verify) .... S PLAT793_ALERT_4_G The Model has Chirality at C10 (Verify) .... S PLAT793_ALERT_4_G The Model has Chirality at C10A (Verify) .... S PLAT860_ALERT_3_G Note: Number of Least-Squares Restraints ....... 4 PLAT912_ALERT_4_G Missing # of FCF Reflections Above STh/L= 0.600 137
0 ALERT level A = Most likely a serious problem - resolve or explain 0 ALERT level B = A potentially serious problem, consider carefully 9 ALERT level C = Check. Ensure it is not caused by an omission or oversight 13 ALERT level G = General information/check it is not something unexpected 0 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 7 ALERT type 3 Indicator that the structure quality may be low 9 ALERT type 4 Improvement, methodology, query or suggestion 2 ALERT type 5 Informative message, check

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