Crystallography Open Database

Information card for entry 7008808

Preview

Coordinates	7008808.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C33 H39 Br3 Cu3 N3
Calculated formula	C33 H39 Br3 Cu3 N3
Title of publication	Structure and photoluminescence property of two-dimensional coordination polymer complexes involving Cu(I)(6)X(6)(X = Cl, Br, I) hexagon prism cluster supported by a tripodal tripyridine ligand with 1,3,5-triethylbenzene spacer.
Authors of publication	Ohi, Hiromi; Tachi, Yoshimitsu; Kunimoto, Takashi; Itoh, Shinobu
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2005
Journal issue	19
Pages of publication	3146 - 3147
a	15.1677 ± 0.0009 Å
b	15.1677 ± 0.0009 Å
c	24.4621 ± 0.0018 Å
α	90°
β	90°
γ	120°
Cell volume	4873.8 ± 0.5 Å³
Cell temperature	163.1 K
Number of distinct elements	5
Space group number	148
Hermann-Mauguin space group symbol	R -3 :H
Hall space group symbol	-R 3
Residual factor for significantly intense reflections	0.0237
Weighted residual factors for all reflections included in the refinement	0.0264
Goodness-of-fit parameter for all reflections included in the refinement	1.018
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176453 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7008808.cif
120443	2014-07-15	Adding 17924 DOIs guessed from source file names.	7008808.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7008808.cif
1504	2010-09-08	cif/7/ Adding data extracted from RSC 2005 and 2006 year publications.	7008808.cif