Crystallography Open Database

Information card for entry 4319331

4319330 << 4319331 >> 4319332

Preview

Coordinates	4319331.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H64 N8 O44 Ti4
Calculated formula	C24 H56 N8 O44 Ti4
Title of publication	Structure and Stability of Water Soluble (NH4)8[Ti4(C6H4O7)4(O2)4].8H2O
Authors of publication	Masato Kakihana; Masaru Tada; Motoo Shiro; Valery Petrykin; Minoru Osada; Yoshiyuki Nakamura
Journal of publication	Inorganic Chemistry
Year of publication	2001
Journal volume	40
Pages of publication	891 - 894
a	10.237 ± 0.002 Å
b	17.537 ± 0.004 Å
c	14.713 ± 0.003 Å
α	90°
β	100.35 ± 0.01°
γ	90°
Cell volume	2598.4 ± 0.9 Å³
Cell temperature	298.2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for significantly intense reflections	0.0389
Weighted residual factors for all reflections included in the refinement	0.1215
Goodness-of-fit parameter for all reflections included in the refinement	1.359
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4319331.cif
120093	2014-07-12	Adding DOIs to range 4/31 structures.	4319331.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4319331.cif
16063	2011-03-19	../uploads/cif-deposit/cod/cif Adding structures of 4319331 via cif-deposit CGI script.	4319331.cif