Crystallography Open Database

Information card for entry 7243394

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Coordinates	7243394.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	B24 Cu11.88 Ni0.12 O48
Calculated formula	B24 Cu11.88 Ni0.12 O48
Title of publication	Metastable growth and infrared spectra of CuB2O4:Ni single crystals
Authors of publication	Moshkina, Evgeniya; Molokeev, Maxim; Belskaya, Nadejda; Nemtsev, Ivan; Molchanova, Anastasiia; Boldyrev, Kirill
Journal of publication	CrystEngComm
Year of publication	2021
Journal volume	23
Journal issue	38
Pages of publication	6761 - 6768
a	11.49731 ± 0.00009 Å
b	11.49731 ± 0.00009 Å
c	5.62593 ± 0.00006 Å
α	90°
β	90°
γ	90°
Cell volume	743.681 ± 0.011 Å³
Cell temperature	300 K
Ambient diffraction temperature	300 K
Number of distinct elements	4
Space group number	122
Hermann-Mauguin space group symbol	I -4 2 d
Hall space group symbol	I -4 2bw
Residual factor R(I) for significantly intense reflections	1.38
Goodness-of-fit parameter for all reflections	1.61
Method of determination	powder diffraction
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.5406 Å
Diffraction radiation type	CuKα~1~~2~
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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