Crystallography Open Database

Information card for entry 7239710

Preview

Coordinates	7239710.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C56 H74 Cd2 Cl4 N16 O25
Calculated formula	C56 H64 Cd2 Cl4 N16 O25
Title of publication	Template effect of innocent and coordinating anions on the formation of interpenetrated 2D and 3D networks: methyl orange and iodine sorption studies
Authors of publication	Baig, Fayaz; Rangan, Krishnan; Eappen, Shibu M.; Mandal, Sanjay K.; Sarkar, Madhushree
Journal of publication	CrystEngComm
Year of publication	2020
Journal volume	22
Journal issue	4
Pages of publication	751 - 766
a	11.4937 ± 0.0006 Å
b	14.6527 ± 0.0007 Å
c	22.6545 ± 0.0006 Å
α	71.776 ± 0.003°
β	87.979 ± 0.003°
γ	85.994 ± 0.004°
Cell volume	3614.7 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0628
Residual factor for significantly intense reflections	0.0558
Weighted residual factors for significantly intense reflections	0.1437
Weighted residual factors for all reflections included in the refinement	0.1492
Goodness-of-fit parameter for all reflections included in the refinement	1.032
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
257451 (current)	2020-10-06	cif/ Updating files of 7239708, 7239709, 7239710, 7239711, 7239712 Original log message: Adding full bibliography for 7239708--7239712.cif.	7239710.cif
247663	2020-02-04	cif/ Updating files of 7239708, 7239709, 7239710, 7239711, 7239712 Original log message: Adding full bibliography for 7239708--7239712.cif.	7239710.cif
246371	2020-01-01	cif/ Adding structures of 7239708, 7239709, 7239710, 7239711, 7239712 via cif-deposit CGI script.	7239710.cif