Crystallography Open Database

Information card for entry 7239708

Preview

Coordinates	7239708.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14 H15 Cl N4 O4
Calculated formula	C14 H15 Cl N4 O4
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	25.482 ± 0.004 Å
b	10.5445 ± 0.0013 Å
c	11.8015 ± 0.0013 Å
α	90°
β	90°
γ	90°
Cell volume	3171 ± 0.7 Å³
Cell temperature	296.15 K
Ambient diffraction temperature	296.15 K
Number of distinct elements	5
Space group number	43
Hermann-Mauguin space group symbol	F d d 2
Hall space group symbol	F 2 -2d
Residual factor for all reflections	0.1068
Residual factor for significantly intense reflections	0.0887
Weighted residual factors for significantly intense reflections	0.2646
Weighted residual factors for all reflections included in the refinement	0.2899
Goodness-of-fit parameter for all reflections included in the refinement	1.162
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
257451 (current)	2020-10-06	cif/ Updating files of 7239708, 7239709, 7239710, 7239711, 7239712 Original log message: Adding full bibliography for 7239708--7239712.cif.	7239708.cif
247663	2020-02-04	cif/ Updating files of 7239708, 7239709, 7239710, 7239711, 7239712 Original log message: Adding full bibliography for 7239708--7239712.cif.	7239708.cif
246371	2020-01-01	cif/ Adding structures of 7239708, 7239709, 7239710, 7239711, 7239712 via cif-deposit CGI script.	7239708.cif