Crystallography Open Database

Information card for entry 4332691

Preview

Coordinates	4332691.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C27 H18 F18 N3 P
Calculated formula	C27 H15 F18 N3 P
Title of publication	Diligating Tripodal Amido-Phosphine Ligands: the Effect of a Proximal Antipodal Early Transition Metal on Phosphine Donor Ability in a Building Block for Heterometallic Complexes
Authors of publication	Han, Hua; Elsmaili, Mona; Johnson, Samuel A.
Journal of publication	Inorganic Chemistry
Year of publication	2006
Journal volume	45
Journal issue	18
Pages of publication	7435 - 7445
a	15.62 ± 0.002 Å
b	16.41 ± 0.002 Å
c	22.386 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	5738.1 ± 1.3 Å³
Cell temperature	143 ± 2 K
Ambient diffraction temperature	143 ± 2 K
Number of distinct elements	5
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0767
Residual factor for significantly intense reflections	0.0654
Weighted residual factors for significantly intense reflections	0.1741
Weighted residual factors for all reflections included in the refinement	0.1871
Goodness-of-fit parameter for all reflections included in the refinement	1.052
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
179429 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/26.	4332691.cif
98485	2014-01-30	cif/ Adding structures of 4332691 via cif-deposit CGI script.	4332691.cif