Crystallography Open Database

Information card for entry 7121844

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Structure parameters

Formula	C17 H26 O7
Calculated formula	C17 H26 O7
Title of publication	Asymmetric synthesis of the fully functionalized six-membered ring of trigoxyphin A.
Authors of publication	Feng, Jing; Yu, Tianzi; Zhang, Zhijiang; Li, Jinpeng; Fu, Shaomin; Chen, Juan; Liu, Bo
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2018
Journal volume	54
Journal issue	55
Pages of publication	7665 - 7668
a	8.9598 ± 0.0003 Å
b	11.7903 ± 0.0003 Å
c	17.2249 ± 0.0005 Å
α	90°
β	90°
γ	90°
Cell volume	1819.62 ± 0.09 Å³
Cell temperature	292.85 ± 0.19 K
Ambient diffraction temperature	292.85 ± 0.19 K
Number of distinct elements	3
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.057
Residual factor for significantly intense reflections	0.0555
Weighted residual factors for significantly intense reflections	0.1315
Weighted residual factors for all reflections included in the refinement	0.1343
Goodness-of-fit parameter for all reflections included in the refinement	1.108
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
301860 (current)	2025-08-22	Add cross-references to PubChem compounds in COD range 7/12/ Each referenced PubChem compound corresponds to the full crystal structure.	7121844.cif
228056	2019-11-17	cif/ Updating files of 7121843, 7121844 Original log message: Adding full bibliography for 7121843--7121844.cif.	7121844.cif
208424	2018-06-16	cif/ Adding structures of 7121843, 7121844 via cif-deposit CGI script.	7121844.cif