Crystallography Open Database

Information card for entry 7716398

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Coordinates	7716398.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H102 B6 Mn2 N8 O96 P12 V12
Calculated formula	C16 H62 B6 Mn2 N8 O96 P12 V12
Title of publication	New types of open-framework vanadium borophosphates with photocatalytic properties.
Authors of publication	Wang, Yiyao; Liu, Xing; Zhou, Jian; Zou, Hua-Hong
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2024
Journal volume	53
Journal issue	28
Pages of publication	11778 - 11786
a	16.1859 ± 0.0011 Å
b	19.7736 ± 0.0014 Å
c	17.097 ± 0.0012 Å
α	90°
β	107.862 ± 0.003°
γ	90°
Cell volume	5208.2 ± 0.6 Å³
Cell temperature	110 ± 2 K
Ambient diffraction temperature	110 ± 2 K
Number of distinct elements	8
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0874
Residual factor for significantly intense reflections	0.0657
Weighted residual factors for significantly intense reflections	0.1804
Weighted residual factors for all reflections included in the refinement	0.203
Goodness-of-fit parameter for all reflections included in the refinement	1.027
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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