Crystallography Open Database

Information card for entry 1561744

Preview

Coordinates	1561744.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C74 H66 N10 Ni3 O30.5 S2
Calculated formula	C74 H56 N10 Ni3 O30.5 S2
Title of publication	Series of coordination polymers based on 4-(5-sulfo-quinolin-8-yloxy) phthalate and bipyridinyl coligands: Structure diversity and properties
Authors of publication	Feng, Xun; Liu, Jing; Li, Jin; Ma, Lu-Fang; Wang, Li-Ya; Ng, Seik-Weng; Qin, Guo-Zhan
Journal of publication	Journal of Solid State Chemistry
Year of publication	2015
Journal volume	230
Pages of publication	80 - 89
a	15.291 ± 0.015 Å
b	11.235 ± 0.012 Å
c	24.984 ± 0.018 Å
α	90°
β	115.28 ± 0.04°
γ	90°
Cell volume	3881 ± 6 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296.15 K
Number of distinct elements	6
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/c 1
Hall space group symbol	-P 2yc
Residual factor for all reflections	0.1898
Residual factor for significantly intense reflections	0.0865
Weighted residual factors for significantly intense reflections	0.1997
Weighted residual factors for all reflections included in the refinement	0.2592
Goodness-of-fit parameter for all reflections included in the refinement	0.965
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
264140 (current)	2021-04-14	cif/ Adding structures of 1561741, 1561742, 1561743, 1561744, 1561745 via cif-deposit CGI script.	1561744.cif