Crystallography Open Database

Information card for entry 7701465

Preview

Coordinates	7701465.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	17199z
Chemical name	Cr(CO)3(((3,5-Me)C6H3)BPPh3)
Formula	C52 H49 B Cr O3.5 P3
Calculated formula	C52 H49 B Cr O3.5 P3
Title of publication	Seventeen-electron chromium(i)tricarbonyltris(phosphine) complexes supported by tris(phosphinomethyl)phenylborates
Authors of publication	Fischer, Paul J.; Senthil, Shuruthi; Stephan, Jeremy T.; Swift, McKinley L.; Young, Victor G.
Journal of publication	Dalton Transactions
Year of publication	2019
a	18.4916 ± 0.0017 Å
b	12.0782 ± 0.0009 Å
c	40.404 ± 0.003 Å
α	90°
β	98.316 ± 0.004°
γ	90°
Cell volume	8929.2 ± 1.3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
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	0.0472
Residual factor for significantly intense reflections	0.0368
Weighted residual factors for significantly intense reflections	0.0859
Weighted residual factors for all reflections included in the refinement	0.0917
Goodness-of-fit parameter for all reflections included in the refinement	1.038
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
220619 (current)	2019-11-01	cif/ Adding structures of 7701464, 7701465, 7701466, 7701467, 7701468, 7701469, 7701470 via cif-deposit CGI script.	7701465.cif