Crystallography Open Database

Information card for entry 7027707

Preview

Coordinates	7027707.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C53 H42 N4 O4 P2 Ru
Calculated formula	C53 H42 N4 O4 P2 Ru
Title of publication	Reactions of ruthenium acetylide complexes with benzylidenemalonitrile †
Authors of publication	Chang, Chao-Wan; Lin, Ying-Chih; Lee, Gene-Hsiang; Wang, Yu
Journal of publication	Journal of the Chemical Society, Dalton Transactions
Year of publication	1999
Journal issue	23
Pages of publication	4223
a	10.4298 ± 0.0014 Å
b	13.883 ± 0.003 Å
c	18.082 ± 0.004 Å
α	107.468 ± 0.022°
β	91.791 ± 0.02°
γ	108.375 ± 0.015°
Cell volume	2347.1 ± 0.9 Å³
Cell temperature	295 K
Ambient diffraction temperature	295 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.11
Residual factor for significantly intense reflections	0.044
Weighted residual factors for all reflections	0.041
Weighted residual factors for significantly intense reflections	0.035
Goodness-of-fit parameter for significantly intense reflections	1.24
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MolybdenumKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7027707.html