Crystallography Open Database

Information card for entry 7038834

Preview

Coordinates	7038834.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H24 I6 N12 P1.08 Zn3
Calculated formula	C36 H24 I6 N12 P1.08 Zn3
Title of publication	Safe P4 reagent in a reusable porous coordination network.
Authors of publication	Choi, Wanuk; Ohtsu, Hiroyoshi; Matsushita, Yoshitaka; Kawano, Masaki
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2016
Journal volume	45
Journal issue	15
Pages of publication	6357 - 6360
a	6.6025 ± 0.0006 Å
b	30.199 ± 0.003 Å
c	12.8199 ± 0.0012 Å
α	90°
β	90.491 ± 0.003°
γ	90°
Cell volume	2556.1 ± 0.4 Å³
Cell temperature	300 ± 2 K
Ambient diffraction temperature	300 ± 2 K
Number of distinct elements	6
Space group number	11
Hermann-Mauguin space group symbol	P 1 21/m 1
Hall space group symbol	-P 2yb
Residual factor for all reflections	0.0807
Residual factor for significantly intense reflections	0.0554
Weighted residual factors for significantly intense reflections	0.0987
Weighted residual factors for all reflections included in the refinement	0.1071
Goodness-of-fit parameter for all reflections included in the refinement	1.041
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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