Crystallography Open Database

Information card for entry 7719673

7719672 << 7719673 >> 7719674

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Coordinates	7719673.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H48 Mo N7
Calculated formula	C36 H48 Mo N7
Title of publication	Exploring early transition metal coordination: a synthetic and computational study of tripodal ligand complexes.
Authors of publication	Moore, Jewelianna M.; Vaught, Brennan M.; Miller, Tabitha J.; Nunn, George; Elford, Lindsey S.; Gullett, Kelly L.; Walton, Paul H.; Fout, Alison R.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2025
a	10.7803 ± 0.0005 Å
b	20.8514 ± 0.0009 Å
c	14.1302 ± 0.0006 Å
α	90°
β	95.334 ± 0.0017°
γ	90°
Cell volume	3162.5 ± 0.2 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0408
Residual factor for significantly intense reflections	0.0371
Weighted residual factors for significantly intense reflections	0.0969
Weighted residual factors for all reflections included in the refinement	0.0992
Goodness-of-fit parameter for all reflections included in the refinement	1.084
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
302957 (current)	2025-10-18	cif/ Adding structures of 7719670, 7719671, 7719672, 7719673 via cif-deposit CGI script.	7719673.cif