Crystallography Open Database

Information card for entry 7214522

Preview

Coordinates	7214522.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C60 H40 N8 O12 Zn2
Calculated formula	C60 H40 N8 O12 Zn2
Title of publication	Construction and modulation of structural diversity in acylamide-MOFs
Authors of publication	Huang, Shu-Yun; Li, Jian-Qiang; Liu, Shu-Juan; Ning, Yang; Meng, Li-Na; Li, Jin-Yuan; Luo, Ming-Biao; Luo, Feng
Journal of publication	CrystEngComm
Year of publication	2014
Journal volume	16
Journal issue	25
Pages of publication	5608
a	9.9223 ± 0.0002 Å
b	14.9699 ± 0.0003 Å
c	21.0207 ± 0.0004 Å
α	77.365 ± 0.001°
β	81.01 ± 0.001°
γ	82.377 ± 0.001°
Cell volume	2993.54 ± 0.1 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.061
Residual factor for significantly intense reflections	0.0417
Weighted residual factors for significantly intense reflections	0.1105
Weighted residual factors for all reflections included in the refinement	0.1165
Goodness-of-fit parameter for all reflections included in the refinement	1.038
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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