Crystallography Open Database

Information card for entry 7003197

Preview

Coordinates	7003197.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	sg190
Formula	C41 H52 N15 O14 Pd2
Calculated formula	C41 H52 N15 O14 Pd2
Title of publication	Coordination driven self-assembly of four new molecular boats using a flexible imidazole-containing donor linker
Authors of publication	Ghosh, Sushobhan; Chakrabarty, Rajesh; Mukherjee, Partha Sarathi
Journal of publication	Dalton Transactions
Year of publication	2008
Journal issue	14
Pages of publication	1850 - 1856
a	14.723 ± 0.005 Å
b	17.227 ± 0.006 Å
c	22.223 ± 0.007 Å
α	90°
β	99.959 ± 0.007°
γ	90°
Cell volume	5552 ± 3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.2181
Residual factor for significantly intense reflections	0.0999
Weighted residual factors for significantly intense reflections	0.258
Weighted residual factors for all reflections included in the refinement	0.3359
Goodness-of-fit parameter for all reflections included in the refinement	0.996
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
179735 (current)	2016-03-25	cif/7/00/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/00/31.	7003197.cif
120443	2014-07-15	Adding 17924 DOIs guessed from source file names.	7003197.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7003197.cif
1173	2010-05-16	cif/7/: adding data from Dalton-Trans-2008, New-J-Chem-2008, Org-Biomol-Chem-2008 and RSC-2008 processing.	7003197.cif