Crystallography Open Database

Information card for entry 4334763

Preview

Coordinates	4334763.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C6 H5 F7 O2 Zn
Calculated formula	C6 H5 F7 O2 Zn
Title of publication	Inorganic and Organozinc Fluorocarboxylates: Synthesis, Structure and Materials Chemistry
Authors of publication	A. L. Johnson; A. J. Kingsley; G. Kociok-Köhn; K. C. Molloy; A. L. Sudlow
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	5515 - 5526
a	19.1655 ± 0.0008 Å
b	10.4966 ± 0.0004 Å
c	10.0172 ± 0.0003 Å
α	90°
β	102.881 ± 0.003°
γ	90°
Cell volume	1964.47 ± 0.13 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	5
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	0.0503
Residual factor for significantly intense reflections	0.0317
Weighted residual factors for significantly intense reflections	0.0729
Weighted residual factors for all reflections included in the refinement	0.0808
Goodness-of-fit parameter for all reflections included in the refinement	1.052
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
179450 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/47.	4334763.cif
100636	2014-02-06	cif/ Adding structures of 4334763 via cif-deposit CGI script.	4334763.cif