Crystallography Open Database

Information card for entry 7721020

Preview

Coordinates	7721020.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C26 H40 Br Mo N O P2
Calculated formula	C26 H40 Br Mo N O P2
Title of publication	A metal-metal quadruply bonded dimer of two pincer-ligated metal centers.
Authors of publication	Mandal, Souvik; Song, Ethan Y.; Emge, Thomas J.; Hasanayn, Faraj; Goldman, Alan S.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2026
Journal volume	55
Journal issue	20
Pages of publication	7816 - 7820
a	11.4244 ± 0.0003 Å
b	9.587 ± 0.0003 Å
c	12.5215 ± 0.0003 Å
α	90°
β	97.018 ± 0.002°
γ	90°
Cell volume	1361.15 ± 0.06 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	7
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/n 1
Hall space group symbol	-P 2yac
Residual factor for all reflections	0.054
Residual factor for significantly intense reflections	0.0512
Weighted residual factors for significantly intense reflections	0.1475
Weighted residual factors for all reflections included in the refinement	0.1497
Goodness-of-fit parameter for all reflections included in the refinement	1.05
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
306407 (current)	2026-06-05	cif/ Updating files of 7721018, 7721019, 7721020, 7721021 Original log message: Adding full bibliography for 7721018--7721021.cif.	7721020.cif
305926	2026-05-11	cif/ Adding structures of 7721018, 7721019, 7721020, 7721021 via cif-deposit CGI script.	7721020.cif