Crystallography Open Database

Information card for entry 7201091

7201090 << 7201091 >> 7201092

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Coordinates	7201091.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H110 N8 O48 P8
Calculated formula	C36 H68 N8 O48 P8
Title of publication	Size and temperature dependent encapsulation of tetrahedral anions by a protonated cryptand host
Authors of publication	Yang, Li-Zi; Li, Yu; Jiang, Long; Feng, Xiao-Long; Lu, Tong-Bu
Journal of publication	CrystEngComm
Year of publication	2009
Journal volume	11
Journal issue	11
Pages of publication	2375 - 2380
a	26.684 ± 0.0007 Å
b	12.7451 ± 0.0005 Å
c	21.3537 ± 0.0005 Å
α	90°
β	98.737 ± 0.002°
γ	90°
Cell volume	7177.9 ± 0.4 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
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	0.1076
Residual factor for significantly intense reflections	0.0728
Weighted residual factors for significantly intense reflections	0.2017
Weighted residual factors for all reflections included in the refinement	0.2382
Goodness-of-fit parameter for all reflections included in the refinement	1.056
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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