Crystallography Open Database

Information card for entry 4514256

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Coordinates	4514256.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C44 H38 Cd N8 O9
Calculated formula	C44 H38 Cd N8 O9
Title of publication	Co(II)-Doped Cd-MOF as an Efficient Water Oxidation Catalyst: Doubly Interpenetrated Boron Nitride Network with the Encapsulation of Free Ligand Containing Pyridine Moieties.
Authors of publication	Maity, Kartik; Bhunia, Kousik; Pradhan, Debabrata; Biradha, Kumar
Journal of publication	ACS applied materials & interfaces
Year of publication	2017
Journal volume	9
Journal issue	43
Pages of publication	37548 - 37553
a	9.4613 ± 0.0009 Å
b	10.6889 ± 0.001 Å
c	20.2009 ± 0.0019 Å
α	84.88 ± 0.003°
β	80.566 ± 0.003°
γ	82.782 ± 0.003°
Cell volume	1994.4 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 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	0.058
Residual factor for significantly intense reflections	0.0416
Weighted residual factors for significantly intense reflections	0.0693
Weighted residual factors for all reflections included in the refinement	0.0716
Goodness-of-fit parameter for all reflections included in the refinement	1.401
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
202548 (current)	2017-11-04	cif/ Adding structures of 4514256 via cif-deposit CGI script.	4514256.cif