Crystallography Open Database

Information card for entry 7125882

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Structure parameters

Formula	C87 H117 N16 O10 P
Calculated formula	C87 H117 N16 O10 P
Title of publication	Chirality transcription in the anion-coordination-driven assembly of tetrahedral cages.
Authors of publication	Fu, Jin; Zheng, Bo; Zhang, Huizheng; Zhao, Yanxia; Zhang, Dan; Zhang, Wenyao; Yang, Xiao-Juan; Wu, Biao
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2020
Journal volume	56
Journal issue	16
Pages of publication	2475 - 2478
a	25.958 ± 0.003 Å
b	25.958 ± 0.003 Å
c	28.548 ± 0.008 Å
α	90°
β	90°
γ	90°
Cell volume	19236 ± 6 Å³
Cell temperature	158 ± 2 K
Ambient diffraction temperature	158.01 K
Number of distinct elements	5
Space group number	112
Hermann-Mauguin space group symbol	P -4 2 c
Hall space group symbol	P -4 2c
Residual factor for all reflections	0.068
Residual factor for significantly intense reflections	0.0674
Weighted residual factors for significantly intense reflections	0.1941
Weighted residual factors for all reflections included in the refinement	0.1955
Goodness-of-fit parameter for all reflections included in the refinement	1.031
Diffraction radiation wavelength	1.54178 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.	7125882.cif
248819	2020-03-05	cif/ Updating files of 7125880, 7125881, 7125882 Original log message: Adding full bibliography for 7125880--7125882.cif.	7125882.cif
247397	2020-01-31	cif/ Adding structures of 7125880, 7125881, 7125882 via cif-deposit CGI script.	7125882.cif