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Information card for 2011742

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Coordinates

2011742.cif

Structure parameters

Formula - C9 H12 O6 -
Calculated formula - C9 H12 O6 -
Title of publication 2',4',6'-Trihydroxy-1-methoxyacetophenone monohydrate at 150 K
Authors of publication Ferreira, Ester S. B.; Hulme, Alison N.; McNab, Hamish; Parsons, Simon; Quye, Anita
Journal of publication Acta Crystallographica, Section C
Year of publication 2001
Journal volume 57
Pages of publication 211 - 212
a 17.3138 ± 0.0005 Å
b 7.333 ± 0.0001 Å
c 16.8507 ± 0.0005 Å
α 90°
β 117.838 ± 0.001°
γ 90°
Cell volume 1891.81 ± 0.08 Å3
Cell temperature 150 ± 2 K
Ambient diffraction temperature 150 ± 2 K
Number of distinct elements 3
Hermann-Mauguin symmetry space group C 1 2/c 1
Hall symmetry space group -C 2yc
Has coordinates Yes
Has disorder No
Has Fobs No

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