Crystallography Open Database

Information card for entry 4088338

Preview

Coordinates	4088338.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C11 H21 F6 N2 P
Calculated formula	C11 H21 F6 N2 P
Title of publication	N-Heterocyclic Carbene Complexes of Three- and Four-Coordinate Fe(I)
Authors of publication	Ohki, Yasuhiro; Hoshino, Ryoko; Tatsumi, Kazuyuki
Journal of publication	Organometallics
Year of publication	2016
Journal volume	35
Journal issue	10
Pages of publication	1368
a	11.922 ± 0.003 Å
b	14.727 ± 0.004 Å
c	8.545 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	1500.3 ± 0.7 Å³
Cell temperature	293 K
Ambient diffraction temperature	293 K
Number of distinct elements	5
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Residual factor for all reflections	0.0851
Residual factor for significantly intense reflections	0.0751
Weighted residual factors for significantly intense reflections	0.2098
Weighted residual factors for all reflections included in the refinement	0.2199
Goodness-of-fit parameter for all reflections included in the refinement	1.085
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
275250 (current)	2022-05-09	cif/4/08/83/ Replaced the '' sequence with a backslash symbol ('\') in multiple data values in entry 4088338.	4088338.cif
237471	2019-11-24	cif/ Adding structures of 4088333, 4088334, 4088335, 4088336, 4088337, 4088338 via cif-deposit CGI script.	4088338.cif