Crystallography Open Database

Information card for entry 7703172

Preview

Coordinates	7703172.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H29 Mo N3 O4 P2
Calculated formula	C42 H29 Mo N3 O4 P2
Title of publication	New 1,2,3-triazole based bis- and trisphosphine ligands: synthesis, transition metal chemistry and catalytic studies.
Authors of publication	Radhakrishna, Latchupatula; Kunchur, Harish S.; Namdeo, Pavan K.; Butcher, Ray J.; Balakrishna, Maravanji S.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	11
Pages of publication	3434 - 3449
a	13.9968 ± 0.0008 Å
b	19.0202 ± 0.0009 Å
c	17.4142 ± 0.0008 Å
α	90°
β	110.22 ± 0.006°
γ	90°
Cell volume	4350.3 ± 0.4 Å³
Cell temperature	150 K
Ambient diffraction temperature	150 K
Number of distinct elements	6
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	0.1534
Residual factor for significantly intense reflections	0.0935
Weighted residual factors for significantly intense reflections	0.1717
Weighted residual factors for all reflections included in the refinement	0.1943
Goodness-of-fit parameter for all reflections included in the refinement	1.077
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
250303 (current)	2020-04-05	cif/ Updating files of 7703162, 7703163, 7703164, 7703165, 7703166, 7703167, 7703168, 7703169, 7703170, 7703171, 7703172 Original log message: Adding full bibliography for 7703162--7703172.cif.	7703172.cif
246465	2020-01-03	cif/ Adding structures of 7703162, 7703163, 7703164, 7703165, 7703166, 7703167, 7703168, 7703169, 7703170, 7703171, 7703172 via cif-deposit CGI script.	7703172.cif