Crystallography Open Database

Information card for entry 7040398

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Coordinates	7040398.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H32 Co N O7 S
Calculated formula	C32 H32 Co N O7 S
Title of publication	Diverse structures of metal-organic frameworks via a side chain adjustment: interpenetration and gas adsorption.
Authors of publication	Shen, Kang; Qin, Ling; Zheng, He-Gen
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2016
Journal volume	45
Journal issue	41
Pages of publication	16205 - 16210
a	15.6669 ± 0.0014 Å
b	20.3997 ± 0.0018 Å
c	21.23 ± 0.002 Å
α	90°
β	109.255 ± 0.002°
γ	90°
Cell volume	6405.6 ± 1 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 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	0.0837
Residual factor for significantly intense reflections	0.0585
Weighted residual factors for significantly intense reflections	0.1712
Weighted residual factors for all reflections included in the refinement	0.1839
Goodness-of-fit parameter for all reflections included in the refinement	1.08
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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