Crystallography Open Database

Information card for entry 7049969

Preview

Coordinates	7049969.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C35 H42 Au N3
Calculated formula	C35 H42 Au N3
Title of publication	Regression analysis of properties of [Au(IPr)(CHR<sub>2</sub>)] complexes.
Authors of publication	Veenboer, Richard M. P.; Azofra, Luis Miguel; Gasperini, Danila; Collado, Alba; Cordes, David B.; Slawin, Alexandra M. Z.; Cavallo, Luigi; Nolan, Steven P.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	22
Pages of publication	7693 - 7703
a	9.4018 ± 0.001 Å
b	17.0518 ± 0.0016 Å
c	10.6058 ± 0.0012 Å
α	90°
β	107.126 ± 0.003°
γ	90°
Cell volume	1624.9 ± 0.3 Å³
Cell temperature	173 K
Ambient diffraction temperature	173 K
Number of distinct elements	4
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.023
Residual factor for significantly intense reflections	0.0194
Weighted residual factors for significantly intense reflections	0.0368
Weighted residual factors for all reflections included in the refinement	0.0374
Goodness-of-fit parameter for all reflections included in the refinement	0.918
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
223829 (current)	2019-11-07	cif/ Updating files of 7049964, 7049965, 7049966, 7049967, 7049968, 7049969 Original log message: Adding full bibliography for 7049964--7049969.cif.	7049969.cif
214982	2019-05-08	cif/ Adding structures of 7049964, 7049965, 7049966, 7049967, 7049968, 7049969 via cif-deposit CGI script.	7049969.cif