Crystallography Open Database

Information card for entry 7705144

Preview

Coordinates	7705144.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C44 H36 Co2 N6 O8 S2
Calculated formula	C44 H36 Co2 N6 O8 S2
Title of publication	Effecting structural diversity in a series of Co(II)-organic frameworks by the interplay between rigidity of a dicarboxylate and flexibility of bis(tridentate) spanning ligands.
Authors of publication	Laha, Biswajit; Khullar, Sadhika; Gogia, Alisha; Mandal, Sanjay K.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	35
Pages of publication	12298 - 12310
a	9.643 ± 0.002 Å
b	14.622 ± 0.004 Å
c	14.166 ± 0.004 Å
α	90°
β	93.433 ± 0.016°
γ	90°
Cell volume	1993.8 ± 0.9 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0378
Residual factor for significantly intense reflections	0.033
Weighted residual factors for significantly intense reflections	0.1066
Weighted residual factors for all reflections included in the refinement	0.1142
Goodness-of-fit parameter for all reflections included in the refinement	0.894
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
257554 (current)	2020-10-06	cif/ Updating files of 7705142, 7705143, 7705144, 7705145 Original log message: Adding full bibliography for 7705142--7705145.cif.	7705144.cif
255305	2020-08-14	cif/ Adding structures of 7705142, 7705143, 7705144, 7705145 via cif-deposit CGI script.	7705144.cif