Crystallography Open Database

Information card for entry 7111231

Preview

Coordinates	7111231.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C8 H30 N3 O24 P5 Zn6
Calculated formula	C8 H22 N3 O24 P5 Zn6
Title of publication	Combinatorial approach for the hydrothermal syntheses of open-framework zinc phosphates
Authors of publication	Song, Yu; Yu, Jihong; Li, Guanghua; Li, Yi; Wang, Yu; Xu, Ruren
Journal of publication	Chemical Communications
Year of publication	2002
Journal issue	16
Pages of publication	1720
a	9.984 ± 0.002 Å
b	12.354 ± 0.003 Å
c	12.834 ± 0.003 Å
α	88.32 ± 0.03°
β	74.57 ± 0.03°
γ	75.81 ± 0.03°
Cell volume	1478.3 ± 0.7 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0508
Residual factor for significantly intense reflections	0.0333
Weighted residual factors for significantly intense reflections	0.0883
Weighted residual factors for all reflections included in the refinement	0.1011
Goodness-of-fit parameter for all reflections included in the refinement	1.042
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
180226 (current)	2016-03-26	cif/7/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/11/12.	7111231.cif
96368	2014-01-29	cif/ Adding structures of 7111231, 7111232 via cif-deposit CGI script.	7111231.cif