Crystallography Open Database

Information card for entry 7125230

Preview

Coordinates	7125230.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C46 H28 N4 Ni
Calculated formula	C46 H28 N4 Ni
Title of publication	Pre-organization of clefts for Ag-π interactions in Zn(ii) bisdipyrrin helicates for the construction of heterometallic networks.
Authors of publication	Baudron, Stéphane A; Hosseini, Mir Wais
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2016
Journal volume	52
Journal issue	88
Pages of publication	13000 - 13003
a	18.03 ± 0.0008 Å
b	11.0785 ± 0.0005 Å
c	16.251 ± 0.0007 Å
α	90°
β	90°
γ	90°
Cell volume	3246.1 ± 0.2 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	4
Space group number	29
Hermann-Mauguin space group symbol	P c a 21
Hall space group symbol	P 2c -2ac
Residual factor for all reflections	0.0689
Residual factor for significantly intense reflections	0.0491
Weighted residual factors for significantly intense reflections	0.1174
Weighted residual factors for all reflections included in the refinement	0.1244
Goodness-of-fit parameter for all reflections included in the refinement	1.001
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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