Crystal data and refinement for Structure 3
New refinement of the crystal structure of Zn(NH3)2Cl2 at 100 K
... 4. Refinement Crystal data, data collection and structure refinement details are summarized in Table 2. Unlike the two previous refine- ments in space group Imam, the unit cell ...
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Crystal structure of N (3 hydroxyphenyl)succinimide
... Crystal data, data collection and structure refinement details are summarized in Table 2. The hydroxyl H atom was located in a difference Fourier map and freely refined. The C-bound H ...
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Synthesis and crystal structure of NaMgFe(MoO4)3
... 4. Refinement Crystal data, data collection and structure refinement details are summarized in Table ...Fe 3+ and Mg 2+ ...
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Crystal structure of benzo[h]quinoline 3 carboxamide
... 5. Refinement Crystal data, data collection and structure refinement details are summarized in Table 2. All C-bound H atoms constitute aromatic protons, which were attached in ...
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Crystal structure of 3 bromo 2 hydroxybenzoic acid
... 6. Refinement Crystal data, data collection and structure refinement details are summarized in Table 3. Positions of hydrogen atoms bonded to carbon atoms were generated ...
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Crystal structure of 3 amino 1 propylpyridinium bromide
... 6. Refinement The details of crystal data, data collection and structure refinement are summarized in Table ...of refinement, the H atoms bound to atom N2 were refined ...
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Crystal structure of 4 (2 bromopropionyl) 3 phenylsydnone
... S3. Refinement Crystal data, data collection and structure refinement details are summarized in the following ...tables. Refinement of the compound resulted in residual ...
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Crystal structure of 1 methylimidazole 3 oxide monohydrate
... 6. Refinement Crystal data, data collection and structure refinement details are summarized in Table ...The data were not of a sufficient quality to reliably determine the ...
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Crystal structure of Na2HfSi2O7 by Rietveld refinement
... The structure of triclinic disodium hafnium disilicate, Na 2 HfSi 2 O 7 , has been determined by laboratory powder X-ray diffraction and refined by the Rietveld ...The structure is a framework made of ...
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Reinvestigation of the crystal structure of Ca2Ce8(SiO4)6O2 apatite by Rietveld refinement
... hexagonal crystal system in space group P6 3 ...present structure, type I cations are statistically occupied by Ca and Ce whereas type II cations are solely occupied by ...
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Crystal structure of 3 carbamothioylpyridinium thiocyanate
... Geometry . All e.s.d.'s (except the e.s.d. in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell e.s.d.'s are taken into account individually in the estimation of ...
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Crystal structure of 3 (diethylamino)phenol
... The molecular structure of the title compound has two molecules in the asymmetric unit. Each molecule has a near planar C 8 NO unit excluding hydrogens and the terminal methyls on the diethylamino groups (C8, C10 ...
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Crystal structure of 3 ethynylbenzoic acid
... in crystal engineering (Dai et ...its crystal structure. Only the crystal structure of the ester, 4-ethynylmethylbenzoate, has been described previously (Dai et ...
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Crystal structure of benzyl 3 (3 methylphenyl)dithiocarbazate
... Geometry . All e.s.d.'s (except the e.s.d. in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell e.s.d.'s are taken into account individually in the estimation of ...
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Data Mining Chemistry and Crystal Structure
... TVDI B TDFOBSJP JU XPVME CF SFBTPOBCMF UP VTF JPOJD TJNJMBSJUZ UP HBUIFS EBUB GSPN BDSPTT TJNJMBS DIFNJTUSJFT 8F DPVME JODMVEF EBUB GSPN JPOT XJUI IJHI JPOJD TVCTUJUVUJPOBM TJNJMBSJUZ MJ[r] ...
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Crystal structure of 3 bromo 2 hydroxybenzonitrile
... Geometry . All e.s.d.'s (except the e.s.d. in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell e.s.d.'s are taken into account individually in the estimation of ...
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Crystal structure of (3 carboxypropyl)triphenylphosphonium hexafluoridophosphate
... Experimental . Absorption correction: SADABS-2014/2 (Bruker, 2014) was used for absorption correction. wR2(int) was 0.0583 before and 0.0488 after correction. The Ratio of minimum to maximum transmission is 0.9133. The ...
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Crystal structure of 4 acetylphenyl 3 methylbenzoate
... molecular structure is stabilized by an intramolecular and the crystal packing by intermolecular C—H···O hydrogen bonds (Table 1 & ...CHCl 3 by slow evaporation ...
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The twinned crystal structure of 3 indolylacetic acid
... Geometry . All e.s.d.'s (except the e.s.d. in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell e.s.d.'s are taken into account individually in the estimation of ...
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Crystal Structure of Na 3 MoCl 6
... synthesis; crystal structure ...a crystal structure [1,2] which contains octahedral molybdenum clusters {Mo 6 } which are surrounded by eight inner (i) and six outer (a) chloride ligands; four ...
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