Crystallography Open Database

Information card for entry 7251916

7251915 << 7251916 >> 7251917

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Coordinates	7251916.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C186 H204 N24 O30
Calculated formula	C186 H204 N24 O30
Title of publication	Robust ditopic enaminone-and hydrazone-linked aminefunctionalized porous organic cage for effective permanganate capture and conversion
Authors of publication	Sheng, Jiajia; Guo, Yanan; Zhang, Guoshi; Wang, Wenjing; Su, Kongzhao; Yuan, Daqiang
Journal of publication	CrystEngComm
Year of publication	2026
a	20.5106 ± 0.0003 Å
b	40.076 ± 0.0005 Å
c	38.3715 ± 0.0005 Å
α	90°
β	96.295 ± 0.001°
γ	90°
Cell volume	31350.5 ± 0.7 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	15
Hermann-Mauguin space group symbol	I 1 2/a 1
Hall space group symbol	-I 2ya
Residual factor for all reflections	0.1354
Residual factor for significantly intense reflections	0.1153
Weighted residual factors for significantly intense reflections	0.3696
Weighted residual factors for all reflections included in the refinement	0.386
Goodness-of-fit parameter for all reflections included in the refinement	1.503
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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