Crystallography Open Database

Information card for entry 1562009

1562008 << 1562009 >> 1562010

Preview

Coordinates	1562009.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C135 H78 O60 P3 Zr9
Calculated formula	C135 H78 O60 P3 Zr9
Title of publication	Chiral and robust Zr(IV)-based metal-organic frameworks built from spiro skeletons.
Authors of publication	Gong, Wei; Liu, Yan; Cui, Yong
Journal of publication	Faraday discussions
Year of publication	2021
Journal volume	231
Journal issue	0
Pages of publication	168 - 180
a	38.1622 ± 0.0009 Å
b	38.1622 ± 0.0009 Å
c	45.5859 ± 0.0015 Å
α	90°
β	90°
γ	120°
Cell volume	57495 ± 3 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
Space group number	180
Hermann-Mauguin space group symbol	P 62 2 2
Hall space group symbol	P 62 2 (0 0 4)
Residual factor for all reflections	0.1096
Residual factor for significantly intense reflections	0.0755
Weighted residual factors for significantly intense reflections	0.1676
Weighted residual factors for all reflections included in the refinement	0.1797
Goodness-of-fit parameter for all reflections included in the refinement	1.026
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
270456 (current)	2021-11-06	cif/ Updating files of 1562006, 1562007, 1562008, 1562009, 1562010 Original log message: Adding full bibliography for 1562006--1562010.cif.	1562009.cif
264443	2021-04-23	cif/ Adding structures of 1562009 via cif-deposit CGI script.	1562009.cif