Crystallography Open Database

Information card for entry 4509005

Preview

Coordinates	4509005.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C31 H34 N4 O4 Zn
Calculated formula	C31 H34 N4 O4 Zn
Title of publication	Hydrothermal Synthesis, Structures, and Luminescent Properties of Seven d10Metal−Organic Frameworks Based on 9,9-Dipropylfluorene-2,7-Dicarboxylic Acid (H2DFDA)
Authors of publication	Guo, Hua-Dong; Guo, Xian-Min; Batten, Stuart R.; Song, Jiang-Feng; Song, Shu-Yan; Dang, Song; Zheng, Guo-Li; Tang, Jin-Kui; Zhang, Hong-Jie
Journal of publication	Crystal Growth & Design
Year of publication	2009
Journal volume	9
Journal issue	3
Pages of publication	1394
a	8.783 ± 0.002 Å
b	24.64 ± 0.006 Å
c	14.613 ± 0.004 Å
α	90°
β	90°
γ	90°
Cell volume	3162.4 ± 1.4 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	57
Hermann-Mauguin space group symbol	P b c m
Hall space group symbol	-P 2c 2b
Residual factor for all reflections	0.1399
Residual factor for significantly intense reflections	0.0877
Weighted residual factors for significantly intense reflections	0.1928
Weighted residual factors for all reflections included in the refinement	0.2179
Goodness-of-fit parameter for all reflections included in the refinement	1.126
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
176432 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.	4509005.cif
97073	2014-01-29	cif/ Adding structures of 4509001, 4509002, 4509003, 4509004, 4509005, 4509006, 4509007 via cif-deposit CGI script.	4509005.cif