Crystallography Open Database

Information card for entry 1572596

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Coordinates	1572596.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C33 H29 B N3 Os P S3
Calculated formula	C33 H29 B N3 Os P S3
Title of publication	Quantifying variation in cooperative B-H bond activations using Os(ii) and Os(iii) κ<sup>2</sup>-<i>N</i>,<i>S</i>-chelated complexes: same, but different.
Authors of publication	Gayen, Sourav; Assanar, Faneesha; Shyamal, Sampad; Dorairaj, Dorothy Priyanka; Ghosh, Sundargopal
Journal of publication	Chemical science
Year of publication	2024
Journal volume	15
Journal issue	38
Pages of publication	15913 - 15924
a	9.516 ± 0.003 Å
b	19.737 ± 0.007 Å
c	19.416 ± 0.006 Å
α	90°
β	93.665 ± 0.009°
γ	90°
Cell volume	3639 ± 2 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0545
Residual factor for significantly intense reflections	0.0378
Weighted residual factors for significantly intense reflections	0.0721
Weighted residual factors for all reflections included in the refinement	0.0787
Goodness-of-fit parameter for all reflections included in the refinement	1.052
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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