Crystallography Open Database

Information card for entry 7700600

Preview

Coordinates	7700600.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C51 H40 Cl2 N2 O P2 Rh2
Calculated formula	C51 H40 Cl2 N2 O P2 Rh2
Title of publication	Rh(i) and Ru(ii) phosphaamidine and phosphaguanidine (1,3-P,N) complexes and their activity for CO<sub>2</sub> hydrogenation.
Authors of publication	Kandel, Ramjee; Schatte, Gabriele; Jessop, Philip G.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	33
Pages of publication	12512 - 12521
a	19.2924 ± 0.0004 Å
b	18.355 ± 0.0004 Å
c	16.0363 ± 0.0004 Å
α	90°
β	102.593 ± 0.001°
γ	90°
Cell volume	5542 ± 0.2 Å³
Cell temperature	180 ± 2 K
Ambient diffraction temperature	180 ± 2 K
Number of distinct elements	7
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.055
Residual factor for significantly intense reflections	0.0366
Weighted residual factors for significantly intense reflections	0.0852
Weighted residual factors for all reflections included in the refinement	0.0926
Goodness-of-fit parameter for all reflections included in the refinement	1.058
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
223981 (current)	2019-11-07	cif/ Updating files of 7700596, 7700597, 7700598, 7700599, 7700600 Original log message: Adding full bibliography for 7700596--7700600.cif.	7700600.cif
217206	2019-07-23	cif/ Adding structures of 7700596, 7700597, 7700598, 7700599, 7700600 via cif-deposit CGI script.	7700600.cif