Crystallography Open Database

Information card for entry 1574965

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Coordinates	1574965.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C60 H104 Cu2 N6 Se2 Si6
Calculated formula	C60 H104 Cu2 N6 Se2 Si6
Title of publication	Driving Diverse Bond Functionalisation with N-Heterocyclic Silylene-Coinage Metal-Aryl Complexes
Authors of publication	Ghosh, Moushakhi; Gaurav, Kumar; Panwaria, Prakash; Panday, Rishukumar; Tothadi, Srinu; Khan, Shabana
Journal of publication	Chemical Science
Year of publication	2025
a	16.06 ± 0.003 Å
b	9.6579 ± 0.0015 Å
c	22.092 ± 0.004 Å
α	90°
β	91.67 ± 0.005°
γ	90°
Cell volume	3425.1 ± 1 Å³
Cell temperature	150 K
Ambient diffraction temperature	150 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0386
Residual factor for significantly intense reflections	0.0285
Weighted residual factors for significantly intense reflections	0.0624
Weighted residual factors for all reflections included in the refinement	0.0671
Goodness-of-fit parameter for all reflections included in the refinement	1.068
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
300268 (current)	2025-07-01	cif/ Adding structures of 1574965, 1574966, 1574967, 1574968, 1574969, 1574970, 1574971, 1574972, 1574973, 1574974, 1574975, 1574976, 1574977, 1574978, 1574979, 1574980, 1574981, 1574982, 1574983, 1574984, 1574985, 1574986, 1574987, 1574988 via cif-deposit CGI script.	1574965.cif