Crystallography Open Database

Information card for entry 7119753

7119752 << 7119753 >> 7119754

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Coordinates	7119753.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C104 H145 N19 O55 Zr6
Calculated formula	C74 H39 N9 O34 Zr6
Title of publication	Pore modulation of zirconium-organic frameworks for high-efficiency detection of trace proteins.
Authors of publication	Liu, Chun-Sen; Zhang, Zhi-Hong; Chen, Min; Zhao, Hui; Duan, Feng-He; Chen, Di-Ming; Wang, Ming-Hua; Zhang, Shuai; Du, Miao
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2017
Journal volume	53
Journal issue	28
Pages of publication	3941
a	38.9025 ± 0.0007 Å
b	38.9025 ± 0.0007 Å
c	18.9223 ± 0.0011 Å
α	90°
β	90°
γ	90°
Cell volume	28637.1 ± 1.8 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	122
Hermann-Mauguin space group symbol	I -4 2 d
Hall space group symbol	I -4 2bw
Residual factor for all reflections	0.0648
Residual factor for significantly intense reflections	0.0558
Weighted residual factors for significantly intense reflections	0.1513
Weighted residual factors for all reflections included in the refinement	0.1611
Goodness-of-fit parameter for all reflections included in the refinement	1.02
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
194923 (current)	2017-04-05	cif/ Updating files of 7119752, 7119753 Original log message: Adding full bibliography for 7119752--7119753.cif.	7119753.cif
194016	2017-03-07	cif/ Adding structures of 7119752, 7119753 via cif-deposit CGI script.	7119753.cif