Crystallography Open Database

Information card for entry 7133611

Preview

Coordinates	7133611.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H34 O
Calculated formula	C22 H34 O
Title of publication	Redox-enabled cooperative catalysis by activating secondary alcohols using low-valent Zn complexes.
Authors of publication	Samanta, Arup; Chaubey, Amit; Pal, Debjyoti; Majhi, Krishna; Srimani, Dipankar
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2024
Journal volume	60
Journal issue	75
Pages of publication	10398 - 10401
a	11.736 ± 0.004 Å
b	6.162 ± 0.002 Å
c	27.346 ± 0.01 Å
α	90°
β	92.424 ± 0.011°
γ	90°
Cell volume	1975.8 ± 1.2 Å³
Cell temperature	297 ± 2 K
Ambient diffraction temperature	297 ± 2 K
Number of distinct elements	3
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.1639
Residual factor for significantly intense reflections	0.0792
Weighted residual factors for significantly intense reflections	0.1902
Weighted residual factors for all reflections included in the refinement	0.2566
Goodness-of-fit parameter for all reflections included in the refinement	1.162
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/7133611.html