Crystallography Open Database

Information card for entry 7219139

7219138 << 7219139 >> 7219140

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Coordinates	7219139.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C75 H44 F18 In2 N4 O14
Calculated formula	C75 H44 F18 In2 N4 O14
Title of publication	Advances in understanding the structure-catalyst activity relationship of green Indium MOFs catalysts in the solvent-free ketones cyanosilylation
Authors of publication	Monge, Angeles; Gutierrez-Puebla, Enrique; Iglesias, Marta; Snejko, Natalia; Aguirre, Lina Maria
Journal of publication	RSC Adv.
Year of publication	2014
a	33.0893 ± 0.0004 Å
b	12.9108 ± 0.0002 Å
c	22.2089 ± 0.0003 Å
α	90°
β	129.956 ± 0.001°
γ	90°
Cell volume	7272.8 ± 0.2 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0422
Residual factor for significantly intense reflections	0.0336
Weighted residual factors for significantly intense reflections	0.0888
Weighted residual factors for all reflections included in the refinement	0.0953
Goodness-of-fit parameter for all reflections included in the refinement	0.995
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
180522 (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 7/21/91.	7219139.cif
128869	2014-12-20	cif/ Adding structures of 7219139, 7219140, 7219141, 7219142 via cif-deposit CGI script.	7219139.cif