Crystallography Open Database

Information card for entry 7232646

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Coordinates	7232646.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C15 H16 N4 Ni O3
Calculated formula	C15 H16 N4 Ni O3
Title of publication	Solvent-Free Synthesis and Reactivity of Nickel(II) Borohydride and Nickel(II) Hydride
Authors of publication	Angamuthu, Raja; Raje, Sakthi
Journal of publication	Green Chemistry
Year of publication	2019
a	30.9603 ± 0.001 Å
b	30.9603 ± 0.001 Å
c	11.4869 ± 0.0005 Å
α	90°
β	90°
γ	120°
Cell volume	9535.5 ± 0.6 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100.2 K
Number of distinct elements	5
Space group number	148
Hermann-Mauguin space group symbol	R -3
Hall space group symbol	-R 3
Residual factor for all reflections	0.0565
Residual factor for significantly intense reflections	0.0429
Weighted residual factors for significantly intense reflections	0.1145
Weighted residual factors for all reflections included in the refinement	0.1283
Goodness-of-fit parameter for all reflections included in the refinement	1.139
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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