Crystallography Open Database

Information card for entry 7213928

Preview

Coordinates	7213928.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H40 Co2 N8 O10
Calculated formula	C36 H40 Co2 N8 O10
Title of publication	Flexible dicarboxylate based pillar-layer metal organic frameworks: differences in structure and porosity by tuning the pyridyl based N,N′ linkers
Authors of publication	Dey, Rajdip; Bhattacharya, Biswajit; Pachfule, Pradip; Banerjee, Rahul; Ghoshal, Debajyoti
Journal of publication	CrystEngComm
Year of publication	2014
Journal volume	16
Journal issue	11
Pages of publication	2305
a	9.8733 ± 0.0003 Å
b	13.7275 ± 0.0005 Å
c	16.1107 ± 0.0005 Å
α	102.603 ± 0.001°
β	105.275 ± 0.001°
γ	106.803 ± 0.002°
Cell volume	1911.32 ± 0.11 Å³
Cell temperature	298 K
Ambient diffraction temperature	298 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	0.0846
Residual factor for significantly intense reflections	0.0446
Weighted residual factors for significantly intense reflections	0.0922
Weighted residual factors for all reflections included in the refinement	0.1049
Goodness-of-fit parameter for all reflections included in the refinement	1.015
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
180470 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/39.	7213928.cif
105210	2014-03-11	cif/ Adding structures of 7213928, 7213929, 7213930, 7213931, 7213932, 7213933 via cif-deposit CGI script.	7213928.cif