Crystallography Open Database

Information card for entry 7000854

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Coordinates	7000854.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C50 H50 N2 O19 P2 Zn4
Calculated formula	C50 H46 N2 O19 P2 Zn4
Title of publication	Metal‒organophosphine and metal‒organophosphonium frameworks with layered honeycomb-like structures
Authors of publication	Humphrey, Simon M.; Allan, Phoebe K.; Oungoulian, Shaunt E.; Ironside, Matthew S.; Wise, Erica R.
Journal of publication	Dalton Transactions
Year of publication	2009
Journal issue	13
Pages of publication	2298 - 2305
a	32.5679 ± 0.0003 Å
b	14.425 ± 0.0002 Å
c	22.2199 ± 0.0004 Å
α	90°
β	130.832 ± 0.0006°
γ	90°
Cell volume	7898.3 ± 0.2 Å³
Cell temperature	180 ± 2 K
Ambient diffraction temperature	180 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.1083
Residual factor for significantly intense reflections	0.0795
Weighted residual factors for significantly intense reflections	0.2194
Weighted residual factors for all reflections included in the refinement	0.2393
Goodness-of-fit parameter for all reflections included in the refinement	1.034
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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