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Checkcif plat934

WebThe asymmetric unit of the title compound, 2C10H11N5O·C6H10O4, consists of a 2,4-diamino-6-(4-methoxyphenyl)-1,3,5-triazine molecule and one-half molecule of adipic acid which lies about an inversion center. The triazine ring makes a dihedral angle of 12.89 (4)° with the adjacent benzene ring. In the crystal, the components are linked by N—H⋯O … WebMay 18, 2024 · CheckCIF-PLAT931-949. Check the proposed Twin Law. The entry in () represents the proposed rotation axis in reciprocal space and the one in [] the …

How to remove Alert level A PLAT939_ALERT_3_A Large Value

Webthe checkcif routine DIFMN03_ALERT_1_C The minimum difference density is < -0.1*ZMAX*0.75 The relevant atom site should be identified. Author Response: This is within the metal core and is attributed to unmodelled \ relatively small twin components. The unmodelled twinning is well below the 10% minor component which is modelled WebPLAT934_ALERT_3_B Number of (Iobs-Icalc)/SigmaW .gt. 10 Outliers . 9 PLAT939_ALERT_3_B Large Value of Not (SHELXL) Weight Optimized S . 282.50 ... experimental section of a paper or in the "special_details" fields of the CIF. checkCIF was carefully designed to identify outliers and unusual parameters, but every test has its … layered fine hair medium haircuts https://futureracinguk.com

checkCIF/PLATON report - University of St Andrews

WebcheckCIF reports on the consistency and integrity of crystal structure determinations reported in CIF format. The following information is organized in question-and-answer … WebDetails of how to use checkCIF/PLATON reports are given elsewhere. Browse tests. Test name: Type: Purpose: ABSMU01: 1: To check that _exptl_absorpt_coefficient_mu value is consistent with the cell contents. ABSTY01: 1: ... PLAT934: 3: Report number of outliers in the FCF file: PLAT935: 2: Pseudo Extinction Parameter Test: PLAT936: 2: Test for ... WebcheckCIF. A service of the International Union of Crystallography. checkCIF reports on the consistency and integrity of crystal structure determinations reported in CIF format. … layered fine hair

checkCIF validation ALERTS: what they mean and how to respond

Category:checkCIF/PLATON report - Semantic Scholar

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Checkcif plat934

(IUCr) IUCr Journals - details of checkCIF/PLATON tests for IUCr …

WebcheckCIF/PLATON report Structure factors have been supplied for datablock(s) Co110 THIS REPORT IS FOR GUIDANCE ONLY. IF USED AS PART OF A REVIEW PROCEDURE FOR PUBLICATION, IT SHOULD NOT REPLACE THE EXPERTISE OF AN EXPERIENCED CRYSTALLOGRAPHIC REFEREE. ... 293 Degree 1 Check Alert level … WebcheckCIF/PLATON report Structure factors have been supplied for datablock(s) 1_a THIS REPORT IS FOR GUIDANCE ONLY. IF USED AS PART OF A REVIEW PROCEDURE FOR ... PLAT934_ALERT_3_C Number of (Iobs-Icalc)/Sigma(W) &gt; 10 Outliers .. 1 Check PLAT971_ALERT_2_C Check Calcd Resid. Dens. 0.41Ang From I3 2.36 eA-3 Author …

Checkcif plat934

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Webchecked using IUCR’s checkcif algorithm. Despite many attempts to collect high quality data, only weak diffraction intensity and data with moderate resolution were obtained due to: radiation damage of the crystals; large volume fractions ... PLAT934_ALERT_3_A Number of (Iobs-Icalc)/SigmaW &gt; 10 Outliers WebcheckCIF was carefully designed to identify outliers and unusual parameters, but every test has its limitations and alerts that are not important in a particular case may appear. …

WebcheckCIF is the IUCr service for checking submissions in CIF format to its own and and other journals. Prospective authors may submit their CIF manuscripts by email or via a web interface, and receive a check report by return email or as a web page. checkCIF on the web How do I use checkCIF? Web interface checkCIF is at Webwhich ranks it as about average compared to other places in kansas in fawn creek there are 3 comfortable months with high temperatures in the range of 70 85 the most ...

WebcheckCIF/PLATON report Structure factors have been supplied for datablock(s) Au6Cu4_complex_1 THIS REPORT IS FOR GUIDANCE ONLY. IF USED AS PART OF … WebPLAT934. This ALERT reports on the number of reflections for which I (obs) and I (calc) differ more that 10 times SigmaW. (The latter being the square root of 1.0/weight for that … A number of tools and templates are available to help with the preparation …

WebcheckCIF/PLATON report Structure factors have been supplied for datablock(s) 11TzH.H3PO2.Sn6I23 THIS REPORT IS FOR GUIDANCE ONLY. IF USED AS PART …

WebcheckCIF/PLATON report Structure factors have been supplied for datablock(s) s THIS REPORT IS FOR GUIDANCE ONLY. IF USED AS PART OF A REVIEW PROCEDURE … layered finger jello recipeWebcheckCIF/PLATON report Structure factors have been supplied for datablock(s) Au10Cu4 THIS REPORT IS FOR GUIDANCE ONLY. IF USED AS PART OF A REVIEW PROCEDURE ... PLAT934_ALERT_3_B Number of (Iobs-Icalc)/Sigma(W) > 10 Outliers .. 3 Check Alert level C layered fine hair short hairstylesWebPLAT934_ALERT_3_B Number of (Iobs-Icalc)/Sigma(W) > 10 Outliers .. 5 Check PLAT971_ALERT_2_B Check Calcd Resid. Dens.0.88AFrom Hf1 3.33 eA-3 PLAT971_ALERT_2_B Check Calcd Resid. Dens.0.92AFrom Hf22.53 eA-3 PLAT972_ALERT_2_B Check Calcd Resid. Dens.1.87AFrom Cl1-3.30 eA-3 … katherine koonce covenantWebColumn chromatography was performed on silica gel 60F (Merck 9385, 0.040–0.063 mm). Routine nuclear magnetic resonance (NMR) spectra were recorded at 25 °C on a Bruker Avance III spectrometer, with working frequencies of 600 and 500 MHz for 1H, and 151.0 and 125.0 MHz for 13C nuclei. layered fine hair stylesWebMagnesium(II) ions with 1.10-phenanthroline(phen) and pyridine(bipy) ligands can form tetraaqua(L) n Magnesium(II)(L = phen, n = 1; L = bipy, n = 2 ) complex cation ... layered first kiss perfume ukhttp://checkcif.iucr.org/ katherine knight early lifeWebcheckCIF/PLATON report Structure factors have been supplied for datablock(s) flik190208 THIS REPORT IS FOR GUIDANCE ONLY. IF USED AS PART OF A REVIEW … layered fishing svg