Crystallography Open Database

Information card for entry 7247202

Preview

Coordinates	7247202.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C312 H276 Cu24 N30 O144
Calculated formula	C320 H312 Cu24 N40 O144
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	30.4107 ± 0.0013 Å
b	30.4107 ± 0.0013 Å
c	30.414 Å
α	90°
β	90°
γ	90°
Cell volume	28127.2 ± 1.7 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	5
Space group number	87
Hermann-Mauguin space group symbol	I 4/m
Hall space group symbol	-I 4
Residual factor for all reflections	0.1298
Residual factor for significantly intense reflections	0.0585
Weighted residual factors for significantly intense reflections	0.1609
Weighted residual factors for all reflections included in the refinement	0.2118
Goodness-of-fit parameter for all reflections included in the refinement	1.182
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
286737 (current)	2023-10-06	cif/ Updating files of 7247201, 7247202 Original log message: Adding full bibliography for 7247201--7247202.cif.	7247202.cif
285774	2023-08-16	cif/ Adding structures of 7247201, 7247202 via cif-deposit CGI script.	7247202.cif