Crystallography Open Database

Information card for entry 1100780

Preview

Coordinates	1100780.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C56 H78 N4
Calculated formula	C56 H78 N4
SMILES	CC(c1cccc(c1/N=C/C(C(/C=N/c1c(cccc1C(C)C)C(C)C)(/C=N/c1c(cccc1C(C)C)C(C)C)C)(/C=N/c1c(cccc1C(C)C)C(C)C)C)C(C)C)C
Title of publication	The First β-Diketiminate-Ag(I) Complexes. Macrocyclic Dinuclear and Tetranuclear Ag(I)-Complexes and Linear Coordination Polymer Ag(I)-Complex
Authors of publication	Chizu Shimokawa; Shinobu Itoh
Journal of publication	Inorganic Chemistry
Year of publication	2005
Journal volume	44
Pages of publication	3010 - 3012
a	11.824 ± 0.002 Å
b	10.358 ± 0.002 Å
c	21.483 ± 0.004 Å
α	90°
β	108.296 ± 0.004°
γ	90°
Cell volume	2498.1 ± 0.8 Å³
Cell temperature	153.1 K
Number of distinct elements	3
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for significantly intense reflections	0.053
Weighted residual factors for all reflections included in the refinement	0.054
Goodness-of-fit parameter for all reflections included in the refinement	1.07
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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