Crystallography Open Database

Information card for entry 7028486

Preview

Coordinates	7028486.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C33 H42 I6 N6 O6 Zn3
Calculated formula	C33 H42 I6 N6 O6 Zn3
Title of publication	Halogen effects on photoluminescence and catalytic properties: a series of spatially arranged trimetallic zinc(ii) complexes.
Authors of publication	Lee, Haeri; Noh, Tae Hwan; Jung, Ok-Sang
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2014
Journal volume	43
Journal issue	10
Pages of publication	3842 - 3849
a	31.9496 ± 0.0002 Å
b	31.9496 ± 0.0002 Å
c	8.0211 ± 0.0001 Å
α	90°
β	90°
γ	120°
Cell volume	7090.8 ± 0.11 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	173
Hermann-Mauguin space group symbol	P 63
Hall space group symbol	P 6c
Residual factor for all reflections	0.0633
Residual factor for significantly intense reflections	0.0529
Weighted residual factors for significantly intense reflections	0.0895
Weighted residual factors for all reflections included in the refinement	0.0923
Goodness-of-fit parameter for all reflections included in the refinement	1.188
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
179990 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/84.	7028486.cif
105338	2014-03-12	cif/ Adding structures of 7028484, 7028485, 7028486 via cif-deposit CGI script.	7028486.cif