Crystallography Open Database

Information card for entry 7100243

Preview

Coordinates	7100243.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14 H18 O6
Calculated formula	C14 H18 O6
SMILES	C1(=O)C[C@@H]2C[C@H]3CCC([C@H]3[C@@H]2O1)(C(=O)OC)C(=O)OC.C1(=O)C[C@H]2C[C@@H]3CCC([C@@H]3[C@H]2O1)(C(=O)OC)C(=O)OC
Title of publication	Synthesis of fused tricyclic g-lactones mediated by manganese(III) acetate.
Authors of publication	Jonathan Burton; David G. Hulcoop
Journal of publication	Chemical Communications
Year of publication	2005
a	7.6093 ± 0.0002 Å
b	12.2244 ± 0.0003 Å
c	14.2977 ± 0.0004 Å
α	90°
β	93.281 ± 0.001°
γ	90°
Cell volume	1327.78 ± 0.06 Å³
Cell temperature	180 ± 2 K
Ambient diffraction temperature	180 ± 2 K
Number of distinct elements	3
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

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