Crystallography Open Database

Information card for entry 7049789

Preview

Coordinates	7049789.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C69.75 H71 B2 Cl0.5 F24 N4 Rh
Calculated formula	C69.75 H71 B2 Cl0.5 F24 N4 Rh
Title of publication	A d<sup>10</sup> Ag(i) amine-borane σ-complex and comparison with a d<sup>8</sup> Rh(i) analogue: structures on the η<sup>1</sup> to η<sup>2</sup>:η<sup>2</sup> continuum.
Authors of publication	Johnson, Alice; Martínez-Martínez, Antonio J; Macgregor, Stuart A.; Weller, Andrew S.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	26
Pages of publication	9776 - 9781
a	12.9702 ± 0.0002 Å
b	16.631 ± 0.0004 Å
c	17.7573 ± 0.0005 Å
α	85.814 ± 0.002°
β	81.7216 ± 0.0018°
γ	81.2409 ± 0.0016°
Cell volume	3741.15 ± 0.15 Å³
Cell temperature	150.01 ± 0.11 K
Ambient diffraction temperature	150.01 ± 0.11 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0524
Residual factor for significantly intense reflections	0.0465
Weighted residual factors for significantly intense reflections	0.1218
Weighted residual factors for all reflections included in the refinement	0.1278
Goodness-of-fit parameter for all reflections included in the refinement	1.042
Diffraction radiation probe	x-ray
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
224059 (current)	2019-11-07	cif/ Updating files of 7049789, 7049790, 7049791, 7049792, 7049793, 7049794 Original log message: Adding full bibliography for 7049789--7049794.cif.	7049789.cif
214729	2019-04-24	cif/ Adding structures of 7049789, 7049790, 7049791, 7049792, 7049793, 7049794 via cif-deposit CGI script.	7049789.cif