Crystallography Open Database

Information card for entry 7716264

Preview

Coordinates	7716264.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H45 Cu6 N20 O12 S
Calculated formula	C42 H45 Cu6 N20 O12 S
Title of publication	Utilization of a trinuclear Cu-pyrazolate inorganic motif to build multifunctional MOFs.
Authors of publication	Saha, Sayan; Akhtar, Sohel; Pramanik, Subhendu; Bala, Sukhen; Mondal, Raju
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2024
Journal volume	53
Journal issue	26
Pages of publication	11021 - 11037
a	11.5378 ± 0.0011 Å
b	15.7422 ± 0.0013 Å
c	16.9487 ± 0.0016 Å
α	107.464 ± 0.003°
β	102.375 ± 0.003°
γ	96.08 ± 0.003°
Cell volume	2820 ± 0.5 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1384
Residual factor for significantly intense reflections	0.0838
Weighted residual factors for significantly intense reflections	0.2332
Weighted residual factors for all reflections included in the refinement	0.2631
Goodness-of-fit parameter for all reflections included in the refinement	1.497
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7716264.html