Crystallography Open Database

Information card for entry 8106948

Preview

Coordinates	8106948.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H18 Br4 Cu F2 N2 O2
Calculated formula	C28 H18 Br4 Cu F2 N2 O2
Title of publication	Crystal structure of bis(2,4-dibromo-6-{(E)[(4-fluorobenzyl)imino]methyl}phenolato-κ2 N,O) copper(II), C28H18Br4F2N2O2Cu
Authors of publication	Lu, Qiong; Lei, KeWei
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2016
Journal volume	231
Journal issue	2
Pages of publication	591 - 592
a	14.6518 ± 0.0008 Å
b	9.6738 ± 0.0005 Å
c	11.1907 ± 0.0006 Å
α	90°
β	121.182 ± 0.008°
γ	90°
Cell volume	1357 ± 0.17 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	7
Space group number	5
Hermann-Mauguin space group symbol	C 1 2 1
Hall space group symbol	C 2y
Residual factor for all reflections	0.0863
Residual factor for significantly intense reflections	0.0723
Weighted residual factors for significantly intense reflections	0.1796
Weighted residual factors for all reflections included in the refinement	0.1966
Goodness-of-fit parameter for all reflections included in the refinement	1.057
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
288219 (current)	2023-12-11	cif/ Removed several misspelt data names since the same space group information is already provided using proper data names.	8106948.cif
281999	2023-03-23	cif/ Adding structures of 8106948 via cif-deposit CGI script.	8106948.cif