Crystallography Open Database

Information card for entry 2204600

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Structure parameters

Chemical name	trans-Diaquabis[2-[3-(dimethylamino)prop-2-enoyl]pyridine]nickel(II) bis(tetrafluoroborate) dimethylformamide tetrasolvate
Formula	C32 H56 B2 F8 N8 Ni O8
Calculated formula	C32 H56 B2 F8 N8 Ni O8
Title of publication	<i>trans</i>-Diaquabis{2-[3-(dimethylamino)prop-2-enoyl]pyridine}nickel(II) bis(tetrafluoroborate) dimethylformamide tetrasolvate
Authors of publication	Ze-Qun Yan
Journal of publication	Acta Crystallographica Section E
Year of publication	2004
Journal volume	60
Journal issue	12
Pages of publication	m1957 - m1958
a	10.036 ± 0.003 Å
b	10.384 ± 0.003 Å
c	13.384 ± 0.003 Å
α	107.744 ± 0.005°
β	93.331 ± 0.005°
γ	118.732 ± 0.005°
Cell volume	1129.4 ± 0.5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1322
Residual factor for significantly intense reflections	0.0742
Weighted residual factors for significantly intense reflections	0.1684
Weighted residual factors for all reflections included in the refinement	0.2005
Goodness-of-fit parameter for all reflections included in the refinement	0.976
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	Yes

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