Crystallography Open Database

Information card for entry 7215675

Preview

Structure parameters

Formula	C60 H48 N18
Calculated formula	C60 H48 N18
SMILES	c1(Cn2ccc(n2)c2ncccc2)c(c(c(c(c1Cn1nc(cc1)c1ncccc1)Cn1nc(cc1)c1ncccc1)Cn1ccc(n1)c1ncccc1)Cn1nc(cc1)c1ncccc1)Cn1nc(cc1)c1ncccc1
Title of publication	Multinuclear coordination polymers based on Ag⋯Ag interaction: syntheses, structures, and luminescence properties
Authors of publication	Shi, Hua-Yu; Dong, Yun-Bo; Liu, Ying-Ying; Ma, Jian-Fang
Journal of publication	CrystEngComm
Year of publication	2014
Journal volume	16
Journal issue	23
Pages of publication	5110
a	10.015 ± 0.0006 Å
b	9.668 ± 0.0006 Å
c	26.365 ± 0.0016 Å
α	90°
β	97.999 ± 0.005°
γ	90°
Cell volume	2528 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 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 all reflections	0.1345
Residual factor for significantly intense reflections	0.0743
Weighted residual factors for significantly intense reflections	0.1935
Weighted residual factors for all reflections included in the refinement	0.241
Goodness-of-fit parameter for all reflections included in the refinement	1.002
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7215675.html