Crystallography Open Database

Information card for entry 7714314

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Coordinates	7714314.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H33 Cl N P
Calculated formula	C22 H33 Cl N P
Title of publication	Bicyclic (Alkyl)(Amino)Carbene (BICAAC) Supported Phosphinidenes
Authors of publication	Kundu, Subrata; Yadav, Ritu; Das, Bindusagar; Singh, Ashi; Anmol, Anmol; Sharma, Ankita; Majumder, Chinmoy
Journal of publication	Dalton Transactions
Year of publication	2023
a	8.8488 ± 0.0004 Å
b	16.8077 ± 0.0009 Å
c	29.576 ± 0.0016 Å
α	90°
β	90°
γ	90°
Cell volume	4398.8 ± 0.4 Å³
Cell temperature	273 ± 2 K
Ambient diffraction temperature	273.15 K
Number of distinct elements	5
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0877
Residual factor for significantly intense reflections	0.0625
Weighted residual factors for significantly intense reflections	0.1566
Weighted residual factors for all reflections included in the refinement	0.1711
Goodness-of-fit parameter for all reflections included in the refinement	1.053
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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