Crystallography Open Database

Information card for entry 7709774

Preview

Coordinates	7709774.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C31 H52 B2 N2 P2
Calculated formula	C31 H52 B2 N2 P2
Title of publication	Synthesis and reactivity of PC(sp3)P-pincer iridium complexes bearing a diborylmethyl anion
Authors of publication	Kishino, Masamichi; Takaoka, Satoko; Shibutani, Yuki; Kusumoto, Shuhei; Nozaki, Kyoko
Journal of publication	Dalton Transactions
Year of publication	2022
a	11.163 ± 0.006 Å
b	12.733 ± 0.007 Å
c	14.239 ± 0.008 Å
α	102.894 ± 0.002°
β	106.128 ± 0.006°
γ	112.723 ± 0.005°
Cell volume	1664 ± 1.6 Å³
Cell temperature	93 K
Ambient diffraction temperature	93 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1193
Residual factor for significantly intense reflections	0.0737
Weighted residual factors for significantly intense reflections	0.1401
Weighted residual factors for all reflections included in the refinement	0.1698
Goodness-of-fit parameter for all reflections included in the refinement	1.045
Diffraction radiation wavelength	0.71075 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/7709774.html