Crystallography Open Database

Information card for entry 4308388

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Coordinates	4308388.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H48 N2 Ni O6
Calculated formula	C16 H16 N2 Ni O6
Title of publication	Knotted Network Consisting of 3-Threads and a Zwitterionic One-Dimensional Polymorphs of trans-3-(3-Pyridyl)acrylate of Cobalt and Nickel, MII(C8H6NO2)2(H2O)2
Authors of publication	Kurmoo, Mohamedally; Estournès, Claude; Oka, Yoshimi; Kumagai, Hitoshi; Inoue, Katsuya
Journal of publication	Inorganic Chemistry
Year of publication	2005
Journal volume	44
Journal issue	2
Pages of publication	217 - 224
a	7.657 ± 0.008 Å
b	9.687 ± 0.01 Å
c	12.04 ± 0.01 Å
α	66.53 ± 0.02°
β	81.18 ± 0.02°
γ	84.64 ± 0.02°
Cell volume	809 ± 1.4 Å³
Cell temperature	273.2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for significantly intense reflections	0.0538
Weighted residual factors for all reflections included in the refinement	0.1671
Goodness-of-fit parameter for all reflections included in the refinement	1.309
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Duplicate of	4300970
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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