Crystallography Open Database

Information card for entry 7128686

Preview

Coordinates	7128686.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H42 B2 N2 O4
Calculated formula	C38 H44 B2 N2 O4
Title of publication	Homolytic cleavage of diboron(4) compounds using diazabutadiene derivatives.
Authors of publication	Verma, Piyush Kumar; Meher, Naresh Kumar; Geetharani, K.
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2021
Journal volume	57
Journal issue	64
Pages of publication	7886 - 7889
a	22.8528 ± 0.0009 Å
b	13.7386 ± 0.0005 Å
c	12.6423 ± 0.0005 Å
α	90°
β	118.405 ± 0.002°
γ	90°
Cell volume	3491.4 ± 0.2 Å³
Cell temperature	296 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
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	0.0971
Residual factor for significantly intense reflections	0.0719
Weighted residual factors for significantly intense reflections	0.1781
Weighted residual factors for all reflections included in the refinement	0.2106
Goodness-of-fit parameter for all reflections included in the refinement	0.935
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
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/7128686.html