Crystallography Open Database

Information card for entry 7027528

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Coordinates	7027528.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C15 H12 N9 Ni O0.5
Calculated formula	C15 H12 N9 Ni O0.5
Title of publication	Synthesis and magnetostructural characterization of two ferromagnetic nickel(II) dimers
Authors of publication	Barandika, M. Gotzone; Cortés, Roberto; Lezama, Luis; Urtiaga, M. Karmele; Arriortua, M. Isabel; Rojo, Teófilo
Journal of publication	Journal of the Chemical Society, Dalton Transactions
Year of publication	1999
Journal issue	17
Pages of publication	2971
a	20.979 ± 0.003 Å
b	7.733 ± 0.001 Å
c	20.117 ± 0.004 Å
α	90°
β	90.29 ± 0.02°
γ	90°
Cell volume	3263.6 ± 0.9 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0762
Residual factor for significantly intense reflections	0.0675
Weighted residual factors for all reflections	0.2251
Weighted residual factors for significantly intense reflections	0.1891
Goodness-of-fit parameter for all reflections	1.062
Goodness-of-fit parameter for significantly intense reflections	1.068
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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