Crystallography Open Database

Information card for entry 4116398

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Structure parameters

Formula	C32 H20
Calculated formula	C32 H20
Title of publication	Construction of Metal Sandwich Systems Derived from Assembly of Silver(I) Complexes with Polycyclic Aromatic Compounds
Authors of publication	Munakata, Megumu; Wu, Liang Ping; Ning, Gui Ling; Kuroda-Sowa, Takayoshi; Maekawa, Masahiko; Suenaga, Yusaku; Maeno, Naoto
Journal of publication	Journal of the American Chemical Society
Year of publication	1999
Journal volume	121
Journal issue	21
Pages of publication	4968 - 4976
a	18.398 ± 0.004 Å
b	6.232 ± 0.003 Å
c	19.902 ± 0.003 Å
α	90°
β	109.88 ± 0.01°
γ	90°
Cell volume	2145.9 ± 1.2 Å³
Cell temperature	296.2 K
Ambient diffraction temperature	296.2 K
Number of distinct elements	2
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.2269
Residual factor for significantly intense reflections	0.0571
Weighted residual factors for significantly intense reflections	0.0401
Weighted residual factors for all reflections included in the refinement	0.0548
Goodness-of-fit parameter for all reflections included in the refinement	1.147
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
301833 (current)	2025-08-20	Add cross-references to PubChem compounds in COD range 4/11/ Each referenced PubChem compound corresponds to the full crystal structure.	4116398.cif
219221	2019-10-09	cif/ Updated bibliographic information in entries 4116398-4116403, 5000178.	4116398.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.	4116398.cif
71012	2013-01-15	cif/ Adding structures of 4116398 via cif-deposit CGI script.	4116398.cif