Crystallography Open Database

Information card for entry 7247201

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Coordinates	7247201.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C52 H84 Cd3 N6 O36
Calculated formula	C52 H52 Cd3 N6 O36
Title of publication	Metal–organic frameworks with open metal sites act as efficient heterogeneous catalysts for Knoevenagel condensation and the Chan–Lam coupling reaction
Authors of publication	Goswami, Anindita; Dutta, Prantik; Biradha, Kumar
Journal of publication	CrystEngComm
Year of publication	2023
Journal volume	25
Journal issue	36
Pages of publication	5092 - 5099
a	36.833 ± 0.005 Å
b	10.295 ± 0.0014 Å
c	20.105 ± 0.003 Å
α	90°
β	102.065 ± 0.006°
γ	90°
Cell volume	7455.3 ± 1.8 Å³
Cell temperature	300 ± 2 K
Ambient diffraction temperature	300 ± 2 K
Number of distinct elements	5
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	0.1367
Residual factor for significantly intense reflections	0.0896
Weighted residual factors for significantly intense reflections	0.2264
Weighted residual factors for all reflections included in the refinement	0.2476
Goodness-of-fit parameter for all reflections included in the refinement	1.34
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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