Crystallography Open Database

Information card for entry 7119277

7119276 << 7119277 >> 7119278

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Coordinates	7119277.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H30 Cu4 N10 O12
Calculated formula	C18 H30 Cu4 N9 O6
Title of publication	Control of bulk homochirality and proton conductivity in isostructural chiral metal-organic frameworks.
Authors of publication	Song, Bai-Qiao; Chen, Da-Qin; Ji, Zhenguo; Tang, Junhong; Wang, Xin-Long; Zang, Hong-Ying; Su, Zhong-Min
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2017
Journal volume	53
Journal issue	11
Pages of publication	1892 - 1895
a	19.6977 ± 0.0013 Å
b	19.6977 ± 0.0013 Å
c	13.8757 ± 0.001 Å
α	90°
β	90°
γ	120°
Cell volume	4662.5 ± 0.5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	182
Hermann-Mauguin space group symbol	P 63 2 2
Hall space group symbol	P 6c 2c
Residual factor for all reflections	0.0782
Residual factor for significantly intense reflections	0.0566
Weighted residual factors for significantly intense reflections	0.1424
Weighted residual factors for all reflections included in the refinement	0.1507
Goodness-of-fit parameter for all reflections included in the refinement	1.006
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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