Crystallography Open Database

Information card for entry 7038553

Preview

Coordinates	7038553.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C68 H54 B2 F24 N P2 Rh
Calculated formula	C68 H54 B2 F24 N P2 Rh
Title of publication	Variable coordination modes and catalytic dehydrogenation of B-phenyl amine-boranes.
Authors of publication	Kumar, Amit; Priest, Isobel K.; Hooper, Thomas N.; Weller, Andrew S.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2016
Journal volume	45
Journal issue	14
Pages of publication	6183 - 6195
a	12.992 ± 0.0003 Å
b	13.1179 ± 0.0003 Å
c	20.8103 ± 0.0006 Å
α	106.257 ± 0.002°
β	93.765 ± 0.002°
γ	95.408 ± 0.002°
Cell volume	3373.93 ± 0.15 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 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	0.0303
Residual factor for significantly intense reflections	0.0278
Weighted residual factors for significantly intense reflections	0.0725
Weighted residual factors for all reflections included in the refinement	0.0741
Goodness-of-fit parameter for all reflections included in the refinement	1.049
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
181720 (current)	2016-04-05	cif/ Updating files of 7038549, 7038550, 7038551, 7038552, 7038553, 7038554, 7038555, 7038556 Original log message: Adding full bibliography for 7038549--7038556.cif.	7038553.cif
176906	2016-02-25	cif/ Adding structures of 7038549, 7038550, 7038551, 7038552, 7038553, 7038554, 7038555, 7038556 via cif-deposit CGI script.	7038553.cif