Crystallography Open Database

Information card for entry 7024331

Preview

Coordinates	7024331.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H30 O14 P2 Ru6
Calculated formula	C48 H29 O14 P2 Ru6
Title of publication	Ligand substitution behavior of Ru(6)(mu(6)-C)(CO)(17) with unsaturated diphosphines: facile capping of a polyhedral face and photochemically promoted P-C bond cleavage in the cluster Ru(6)(mu(6)-C)(CO)(14)(mu(3)-bpcd).
Authors of publication	Kandala, Srikanth; Hammons, Casey; Watson, William H.; Wang, Xiaoping; Richmond, Michael G.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2010
Journal volume	39
Journal issue	6
Pages of publication	1620 - 1629
a	11.5447 ± 0.0017 Å
b	12.7133 ± 0.0019 Å
c	19.17 ± 0.003 Å
α	95.733 ± 0.002°
β	96.007 ± 0.002°
γ	116.221 ± 0.002°
Cell volume	2476.3 ± 0.7 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0912
Residual factor for significantly intense reflections	0.0434
Weighted residual factors for significantly intense reflections	0.0634
Weighted residual factors for all reflections included in the refinement	0.0708
Goodness-of-fit parameter for all reflections included in the refinement	0.945
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
179948 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/43.	7024331.cif
92420	2014-01-12	cif/ Adding structures of 7024331, 7024332, 7024333, 7024334, 7024335, 7024336 via cif-deposit CGI script.	7024331.cif