Crystallography Open Database

Information card for entry 7112806

Preview

Coordinates	7112806.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C15 H10 Cl3 Cu N3 O2
Calculated formula	C15 H10 Cl3 Cu N3 O2
SMILES	c1cccc2[n]1[Cu]1([n]3c2cc(cc3c2cccc[n]12)Cl)(Cl)Cl.O.O
Title of publication	Fluorescent receptor-immobilized silica-coated magnetic nanoparticles as a general binding agent for histidine-tagged proteins.
Authors of publication	Cho, Eun Jin; Jung, Sera; Lee, Kwangho; Lee, Hong Joo; Nam, Kye Chun; Bae, Hyeun-Jong
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2010
Journal volume	46
Journal issue	35
Pages of publication	6557 - 6559
a	10.3495 ± 0.0007 Å
b	13.5576 ± 0.0009 Å
c	12.7601 ± 0.0009 Å
α	90°
β	111.598 ± 0.001°
γ	90°
Cell volume	1664.7 ± 0.2 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	12
Hermann-Mauguin space group symbol	C 1 2/m 1
Hall space group symbol	-C 2y
Residual factor for all reflections	0.0547
Residual factor for significantly intense reflections	0.0459
Weighted residual factors for significantly intense reflections	0.1025
Weighted residual factors for all reflections included in the refinement	0.106
Goodness-of-fit parameter for all reflections included in the refinement	1.121
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
180242 (current)	2016-03-26	cif/7/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/11/28.	7112806.cif
112099	2014-04-29	cif/ Adding structures of 7112806 via cif-deposit CGI script.	7112806.cif