Crystallography Open Database

Information card for entry 7030697

Preview

Coordinates	7030697.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	(Ru(NO)(terpy)(glyac))BPh4
Formula	C43 H39 B N4 O5 Ru S
Calculated formula	C43 H39 B N4 O5 Ru S
Title of publication	Nitric-oxide photorelease and photoinduced linkage isomerism on solid [Ru(NO)(terpy)(L)]BPh4 (L = glycolate dianion)
Authors of publication	Giglmeier, Helene; Kerscher, Tobias; Klüfers, Peter; Schaniel, Dominik; Woike, Theo
Journal of publication	Dalton Transactions
Year of publication	2009
Journal issue	42
Pages of publication	9113 - 9116
a	11.3863 ± 0.0002 Å
b	23.9172 ± 0.0005 Å
c	28.1252 ± 0.0005 Å
α	90°
β	90°
γ	90°
Cell volume	7659.3 ± 0.2 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	7
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	0.1392
Residual factor for significantly intense reflections	0.0515
Weighted residual factors for significantly intense reflections	0.0979
Weighted residual factors for all reflections included in the refinement	0.1263
Goodness-of-fit parameter for all reflections included in the refinement	1.003
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Duplicate of	7002652
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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