Crystallography Open Database

Information card for entry 4111373

Preview

Coordinates	4111373.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C132 H283 N35.5 O51.5 Pd6
Calculated formula	C132 H165 N35.5 O51.5 Pd6
Title of publication	Engineering Stacks of Aromatic Rings by the Interpenetration of Self-Assembled Coordination Cages
Authors of publication	Yoshihiro Yamauchi; Michito Yoshizawa; Makoto Fujita
Journal of publication	Journal of the American Chemical Society
Year of publication	2008
Journal volume	130
Pages of publication	5832 - 5833
a	22.152 ± 0.003 Å
b	22.625 ± 0.003 Å
c	25.961 ± 0.003 Å
α	106.748 ± 0.002°
β	110.284 ± 0.002°
γ	101.93 ± 0.002°
Cell volume	10985 ± 2 Å³
Cell temperature	80 ± 2 K
Ambient diffraction temperature	80 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.2435
Residual factor for significantly intense reflections	0.1167
Weighted residual factors for significantly intense reflections	0.3181
Weighted residual factors for all reflections included in the refinement	0.3655
Goodness-of-fit parameter for all reflections included in the refinement	0.961
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
295947 (current)	2024-11-16	Replaced the '\/Y' character sequence with the backslash character ('\') in multiple data values.	4111373.cif
176467	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4111373.cif
120077	2014-07-12	Adding DOIs to range 4/11 structures.	4111373.cif
60901	2012-06-19	cif/ Adding structures of 4111373 via cif-deposit CGI script.	4111373.cif