Crystallography Open Database

Information card for entry 7016505

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Coordinates	7016505.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C121 H100 N16 O4
Calculated formula	C109 H72 N12
Title of publication	Luminescent infinite coordination polymer materials from metal-terpyridine ligation.
Authors of publication	Eryazici, Ibrahim; Farha, Omar K.; Compton, Owen C.; Stern, Charlotte; Hupp, Joseph T.; Nguyen, Sonbinh T.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2011
Journal volume	40
Journal issue	36
Pages of publication	9189 - 9193
a	11.0736 ± 0.0008 Å
b	19.9537 ± 0.0013 Å
c	22.853 ± 0.0014 Å
α	91.877 ± 0.006°
β	97.134 ± 0.006°
γ	92.099 ± 0.006°
Cell volume	5003.6 ± 0.6 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1595
Residual factor for significantly intense reflections	0.0736
Weighted residual factors for significantly intense reflections	0.1731
Weighted residual factors for all reflections included in the refinement	0.2047
Goodness-of-fit parameter for all reflections included in the refinement	0.819
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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