Crystallography Open Database

Information card for entry 7219505

7219504 << 7219505 >> 7219506

Preview

Coordinates	7219505.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C44 H42 N4 O20 Zn3
Calculated formula	C44 H42 N4 O20 Zn3
Title of publication	Acid-induced Zn(ii)-based metal‒organic frameworks for encapsulation and sensitization of lanthanide cations
Authors of publication	He, Hongjie; Zhang, Lina; Deng, Mingli; Chen, Zhenxia; Ling, Yun; Chen, Jinxi; Zhou, Yaming
Journal of publication	CrystEngComm
Year of publication	2015
Journal volume	17
Journal issue	11
Pages of publication	2294
a	16.646 ± 0.006 Å
b	18.345 ± 0.007 Å
c	16.309 ± 0.006 Å
α	90°
β	108.893 ± 0.004°
γ	90°
Cell volume	4712 ± 3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0687
Residual factor for significantly intense reflections	0.0473
Weighted residual factors for significantly intense reflections	0.1199
Weighted residual factors for all reflections included in the refinement	0.1342
Goodness-of-fit parameter for all reflections included in the refinement	0.954
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
180526 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/95.	7219505.cif
133229	2015-03-06	cif/ Updating files of 7219505, 7219506 Original log message: Adding full bibliography for 7219505--7219506.cif.	7219505.cif
131219	2015-02-06	cif/ Adding structures of 7219505, 7219506 via cif-deposit CGI script.	7219505.cif