Crystallography Open Database

Information card for entry 7220820

7220819 << 7220820 >> 7220821

Preview

Coordinates	7220820.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H22 N2 O11 Zn2
Calculated formula	C20 H22 N2 O11 Zn2
Title of publication	Study of temperature and ligand flexibility effects on coordination polymer formation from cyclobutanetetracarboxylic acid
Authors of publication	Bello, Lizaira; Quintero, Marilyn; Mora, Asiloé J.; González, Teresa; Escalona, Ana; Añez, Rafael; Ávila, Edward E.; Briceño, Alexander
Journal of publication	CrystEngComm
Year of publication	2015
Journal volume	17
Journal issue	31
Pages of publication	5921
a	15.023 ± 0.002 Å
b	10.1643 ± 0.0013 Å
c	18.196 ± 0.003 Å
α	90°
β	114.233 ± 0.002°
γ	90°
Cell volume	2533.7 ± 0.6 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0403
Residual factor for significantly intense reflections	0.0319
Weighted residual factors for significantly intense reflections	0.0731
Weighted residual factors for all reflections included in the refinement	0.0788
Goodness-of-fit parameter for all reflections included in the refinement	1.048
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
153110 (current)	2015-08-08	cif/ Updating files of 7220820, 7220821, 7220822 Original log message: Adding full bibliography for 7220820--7220822.cif.	7220820.cif
139494	2015-06-23	cif/ Adding structures of 7220820, 7220821, 7220822 via cif-deposit CGI script.	7220820.cif