Crystallography Open Database

Information card for entry 7227905

Preview

Coordinates	7227905.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C62 H46 Cd3 N6 O16
Calculated formula	C62 H46 Cd3 N6 O16
Title of publication	Cd(ii) coordination polymers constructed with a flexible carboxylate linker and pyridyl co-linkers: variation in the network topologies and photoluminescence properties
Authors of publication	Gupta, Anoop K.; Tomar, Kapil; Bharadwaj, Parimal K.
Journal of publication	CrystEngComm
Year of publication	2017
Journal volume	19
Journal issue	16
Pages of publication	2253
a	16.164 ± 0.005 Å
b	11.755 ± 0.005 Å
c	20.199 ± 0.004 Å
α	90°
β	120.402 ± 0.017°
γ	90°
Cell volume	3310.2 ± 1.9 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/c 1
Hall space group symbol	-P 2yc
Residual factor for all reflections	0.0961
Residual factor for significantly intense reflections	0.0593
Weighted residual factors for significantly intense reflections	0.1531
Weighted residual factors for all reflections included in the refinement	0.1683
Goodness-of-fit parameter for all reflections included in the refinement	1.007
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
196381 (current)	2017-05-06	cif/ Updating files of 7227900, 7227901, 7227902, 7227903, 7227904, 7227905 Original log message: Adding full bibliography for 7227900--7227905.cif.	7227905.cif
194393	2017-03-22	cif/ Adding structures of 7227900, 7227901, 7227902, 7227903, 7227904, 7227905 via cif-deposit CGI script.	7227905.cif