Crystallography Open Database

Information card for entry 8101472

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Coordinates	8101472.cif

Structure parameters

Formula	C17 H24 O7
Calculated formula	C17 H24 O7
Title of publication	Crystal structure of trimethyl 3-methyl-4-oxo-(E)-8-cyclodecene-1, 1,6-tricarboxylate, C17H24O7
Authors of publication	Ullmann, Astrid; Zahn, Gernot; Schnaubelt, Jürgen; Reissig, Hans-Ulrich
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	1999
Journal volume	214
Journal issue	2
Pages of publication	221 - 223
a	7.8574 ± 0.0006 Å
b	14.791 ± 0.0011 Å
c	16.8742 ± 0.0015 Å
α	107.16 ± 0.005°
β	99.995 ± 0.005°
γ	97.512 ± 0.005°
Cell volume	1810.5 ± 0.3 Å³
Cell temperature	298 ± 2 K
Number of distinct elements	3
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for significantly intense reflections	0.0494
Weighted residual factors for significantly intense reflections	0.0948
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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