Crystallography Open Database

Information card for entry 4513614

Preview

Coordinates	4513614.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H28 N6 O11 Zn2
Calculated formula	C40 H28 N6 O11 Zn2
Title of publication	New Series of ZnII/CdIIMixed Ligand Coordination Polymers: Toward the Design of Metallogels
Authors of publication	Husain, Ahmad; Parveen, Rumana; Dastidar, Parthasarathi
Journal of publication	Crystal Growth & Design
Year of publication	2015
Journal volume	15
Journal issue	10
Pages of publication	5075
a	7.95 ± 0.003 Å
b	9.073 ± 0.003 Å
c	27.881 ± 0.01 Å
α	89.3 ± 0.005°
β	84.163 ± 0.005°
γ	67.577 ± 0.004°
Cell volume	1848.6 ± 1.1 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0926
Residual factor for significantly intense reflections	0.0574
Weighted residual factors for significantly intense reflections	0.1318
Weighted residual factors for all reflections included in the refinement	0.1426
Goodness-of-fit parameter for all reflections included in the refinement	1.046
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
170778 (current)	2015-12-06	cif/ Updating files of 4513613, 4513614, 4513615, 4513616, 4513617, 4513618, 4513619, 4513620 Original log message: Adding full bibliography for 4513613--4513620.cif.	4513614.cif
156330	2015-09-16	cif/ Adding structures of 4513614 via cif-deposit CGI script.	4513614.cif