Crystallography Open Database

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Searching journal of publication like 'Journal of Molecular Structure' volume of publication is 112

COD ID: 5000159
CIF file Formula: - C8 H18 O2 -
Comments: Slovokhotov, Yu. L.; Timofeeva, T. V.; Antipin, M. Yu.; Struchkov, Yu. T. Distortion of "tetrahedral" C~3v~ coordination in the R~3~C‒O moiety due to the reduction of molecular symmetry: X-ray, conformational, and quantum-chemical study Journal of Molecular Structure 112(1-2) (1984) 127-140
Space group: P 1 21/n 1
Cell volume: 990.2
Cell parameters: 8.181; 11.833; 10.392; 90; 100.17; 90;  


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